4-[[3-[4-(2-methylphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[[3-[4-(2-methylphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[[3-[4-(o-tolyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one CAS Name: 4-[[3-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[[3-[4-(2-methylphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[3-[4-(o-tolyl)piperazine-1-carbonyl]benzyl]-1,4-benzoxazin-3-one Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)CN4C(=O)COC5=CC=CC=C54

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)CN4C(=O)COC5=CC=CC=C54

InChI

InChI=1S/C27H27N3O3/c1-20-7-2-3-10-23(20)28-13-15-29(16-14-28)27(32)22-9-6-8-21(17-22)18-30-24-11-4-5-12-25(24)33-19-26(30)31/h2-12,17H,13-16,18-19H2,1H3