2-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-5-oxidanyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 2-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-5-oxidanyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 2-[4-(4-benzhydrylpiperazin-1-yl)butyl]-5-hydroxy-4-oxo-1H-quinoline-3-carboxamide CAS Name: 2-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]-5-hydroxy-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 2-[4-(4-benzhydrylpiperazin-1-yl)butyl]-5-hydroxy-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 2-[4-(4-benzhydrylpiperazino)butyl]-5-hydroxy-4-keto-1H-quinoline-3-carboxamide Formula: C31H34N4O3 MolecularWeight: 510.62666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=C(C(=O)C3=C(N2)C=CC=C3O)C(=O)N)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCC2=C(C(=O)C3=C(N2)C=CC=C3O)C(=O)N)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34N4O3/c32-31(38)28-25(33-24-15-9-16-26(36)27(24)30(28)37)14-7-8-17-34-18-20-35(21-19-34)29(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-6,9-13,15-16,29,36H,7-8,14,17-21H2,(H2,32,38)(H,33,37)