7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methylpyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H29FN4O4 MolecularWeight: 456.509863

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)CN(C)CCC#N

Isomeric SMILES

CC1(CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)CN(C)CCC#N

InChI

InChI=1S/C24H29FN4O4/c1-24(13-27(2)9-4-8-26)7-10-28(14-24)20-18(25)11-16-19(22(20)33-3)29(15-5-6-15)12-17(21(16)30)23(31)32/h11-12,15H,4-7,9-10,13-14H2,1-3H3,(H,31,32)