2-[[4-(3-methylphenyl)carbonylpiperazin-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 2-[[4-(3-methylphenyl)carbonylpiperazin-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 2-[[4-(3-methylbenzoyl)piperazin-1-yl]methyl]-1H-quinolin-4-one CAS Name: 2-[[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-1H-quinolin-4-one IUPAC Name: 2-[[4-(3-methylbenzoyl)piperazin-1-yl]methyl]-1H-quinolin-4-one Traditional Name: 2-[(4-m-toluoylpiperazino)methyl]-4-quinolone Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H23N3O2/c1-16-5-4-6-17(13-16)22(27)25-11-9-24(10-12-25)15-18-14-21(26)19-7-2-3-8-20(19)23-18/h2-8,13-14H,9-12,15H2,1H3,(H,23,26)