3-(4-fluoranyl-3-methyl-phenyl)-1-methyl-6-(quinolin-2-ylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one

Systemtic Name: 3-(4-fluoranyl-3-methyl-phenyl)-1-methyl-6-(quinolin-2-ylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one Openeye Name: 3-(4-fluoro-3-methyl-phenyl)-1-methyl-6-(2-quinolylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one CAS Name: 3-(4-fluoro-3-methylphenyl)-1-methyl-6-(2-quinolinylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one IUPAC Name: 3-(4-fluoro-3-methylphenyl)-1-methyl-6-(quinolin-2-ylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one Traditional Name: 3-(4-fluoro-3-methyl-phenyl)-1-methyl-6-(2-quinolylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one Formula: C26H25FN3O+ MolecularWeight: 414.494603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC3=C(CC[NH+](C3)CC4=NC5=CC=CC=C5C=C4)N(C2=O)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC3=C(CC[NH+](C3)CC4=NC5=CC=CC=C5C=C4)N(C2=O)C)F

InChI

InChI=1S/C26H24FN3O/c1-17-13-19(8-10-23(17)27)22-14-20-15-30(12-11-25(20)29(2)26(22)31)16-21-9-7-18-5-3-4-6-24(18)28-21/h3-10,13-14H,11-12,15-16H2,1-2H3/p+1