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

Systemtic Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-1-pyrrolidinyl]-1-cyclopropyl-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methylpyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-3-methyl-pyrrolidino]-1-cyclopropyl-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H30N4O4 MolecularWeight: 438.5194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC)CN(C)CCC#N

Isomeric SMILES

CC1(CCN(C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC)CN(C)CCC#N

InChI

InChI=1S/C24H30N4O4/c1-24(14-26(2)11-4-10-25)9-12-27(15-24)19-8-7-17-20(22(19)32-3)28(16-5-6-16)13-18(21(17)29)23(30)31/h7-8,13,16H,4-6,9,11-12,14-15H2,1-3H3,(H,30,31)