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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C2=CNC3=C(C2=O)C(=CC=C3)O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C2=CNC3=C(C2=O)C(=CC=C3)O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34N4O3/c36-27-15-9-14-26-28(27)30(37)25(22-33-26)31(38)32-16-7-8-17-34-18-20-35(21-19-34)29(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-6,9-15,22,29,36H,7-8,16-21H2,(H,32,38)(H,33,37)