6-ethoxy-4-oxidanylidene-N-[[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]methyl]-1H-quinoline-3-carboxamide

Systemtic Name: 6-ethoxy-4-oxidanylidene-N-[[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]methyl]-1H-quinoline-3-carboxamide Openeye Name: N-[[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]methyl]-6-ethoxy-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-ethoxy-4-oxo-N-[[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]methyl]-1H-quinoline-3-carboxamide IUPAC Name: N-[[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]methyl]-6-ethoxy-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]benzyl]-6-ethoxy-4-keto-1H-quinoline-3-carboxamide Formula: C31H34N4O3 MolecularWeight: 510.62666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)CN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)CN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H34N4O3/c1-2-38-26-12-13-29-27(18-26)30(36)28(20-32-29)31(37)33-19-23-8-10-25(11-9-23)22-35-16-14-34(15-17-35)21-24-6-4-3-5-7-24/h3-13,18,20H,2,14-17,19,21-22H2,1H3,(H,32,36)(H,33,37)