7-methyl-3-[[[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]amino]methyl]-1H-quinolin-2-one

Systemtic Name: 7-methyl-3-[[[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]amino]methyl]-1H-quinolin-2-one Openeye Name: 3-[[4-(4-benzylpiperazin-1-yl)anilino]methyl]-7-methyl-1H-quinolin-2-one CAS Name: 7-methyl-3-[[4-[4-(phenylmethyl)-1-piperazinyl]anilino]methyl]-1H-quinolin-2-one IUPAC Name: 3-[[4-(4-benzylpiperazin-1-yl)anilino]methyl]-7-methyl-1H-quinolin-2-one Traditional Name: 3-[[4-(4-benzylpiperazino)anilino]methyl]-7-methyl-carbostyril Formula: C28H30N4O MolecularWeight: 438.564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CNC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CNC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O/c1-21-7-8-23-18-24(28(33)30-27(23)17-21)19-29-25-9-11-26(12-10-25)32-15-13-31(14-16-32)20-22-5-3-2-4-6-22/h2-12,17-18,29H,13-16,19-20H2,1H3,(H,30,33)