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

Systemtic Name: 4-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one CAS Name: 4-[[3-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzyl]-1,4-benzoxazin-3-one Formula: C27H27N3O4 MolecularWeight: 457.52098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)CN4C(=O)COC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)CN4C(=O)COC5=CC=CC=C54

InChI

InChI=1S/C27H27N3O4/c1-33-24-11-4-2-9-22(24)28-13-15-29(16-14-28)27(32)21-8-6-7-20(17-21)18-30-23-10-3-5-12-25(23)34-19-26(30)31/h2-12,17H,13-16,18-19H2,1H3