Mrv1652309092202402D 20 21 0 0 0 0 999 V2000 6.4302 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5737 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2881 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0026 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7171 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4315 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8605 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5749 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5749 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5749 -4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8605 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8605 -3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -2.8875 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.4315 -3.3000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 13 18 1 0 0 0 0 18 19 2 0 0 0 0 9 19 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 2 19 1 20 -1 M END > NP0276498 > NP-MRD > CCCCCCCCC1=CC(O)=C2C=CC=CC2=[N+]1[O-] > InChI=1S/C17H23NO2/c1-2-3-4-5-6-7-10-14-13-17(19)15-11-8-9-12-16(15)18(14)20/h8-9,11-13,19H,2-7,10H2,1H3 > UKKYWOFQJOMYIL-UHFFFAOYSA-N > C17H23NO2 > 273.376 > 273.172878985 > 2 > 43 > 32.623697282524205 > 1 > 1 > 0 > 1 > 4-hydroxy-2-octylquinolin-1-ium-1-olate > 4.279371751999999 > 0 > 2 > 0 > 8.596152527270945 > 3.490686432387809 > 47.17 > 82.59590000000001 > 7 > 1 > 4-hydroxy-2-octylquinolin-1-ium-1-olate > 0 > NP0276498 > 4-hydroxy-2-octylquinolin-1-ium-1-olate $$$$