4-[4-[(2-methyl-4-naphthalen-1-yl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinolin-3-yl)carbonyl]piperazin-1-yl]benzoic acid

Systemtic Name: 4-[4-[(2-methyl-4-naphthalen-1-yl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinolin-3-yl)carbonyl]piperazin-1-yl]benzoic acid Openeye Name: 4-[4-[2-methyl-4-(1-naphthyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonyl]piperazin-1-yl]benzoic acid CAS Name: 4-[4-[[2-methyl-4-(1-naphthalenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-3-yl]-oxomethyl]-1-piperazinyl]benzoic acid IUPAC Name: 4-[4-(2-methyl-4-naphthalen-1-yl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonyl)piperazin-1-yl]benzoic acid Traditional Name: 4-[4-[5-keto-2-methyl-4-(1-naphthyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carbonyl]piperazino]benzoic acid Formula: C32H31N3O4 MolecularWeight: 521.60624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC4=CC=CC=C43)C(=O)N5CCN(CC5)C6=CC=C(C=C6)C(=O)O

Isomeric SMILES

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC4=CC=CC=C43)C(=O)N5CCN(CC5)C6=CC=C(C=C6)C(=O)O

InChI

InChI=1S/C32H31N3O4/c1-20-28(31(37)35-18-16-34(17-19-35)23-14-12-22(13-15-23)32(38)39)29(30-26(33-20)10-5-11-27(30)36)25-9-4-7-21-6-2-3-8-24(21)25/h2-4,6-9,12-15,29,33H,5,10-11,16-19H2,1H3,(H,38,39)