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

Systemtic Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]-1-pyrrolidinyl]-1-cyclopropyl-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[[2-cyanoethyl(methyl)amino]methyl]pyrrolidino]-1-cyclopropyl-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CCC(C4)CN(C)CCC#N

Isomeric SMILES

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CCC(C4)CN(C)CCC#N

InChI

InChI=1S/C23H28N4O3/c1-15-20(26-11-8-16(13-26)12-25(2)10-3-9-24)7-6-18-21(15)27(17-4-5-17)14-19(22(18)28)23(29)30/h6-7,14,16-17H,3-5,8,10-13H2,1-2H3,(H,29,30)