4-[(3-methylphenyl)methyl]-7-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[(3-methylphenyl)methyl]-7-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,4-benzoxazin-3-one Openeye Name: 7-(4-benzylpiperazine-1-carbonyl)-4-(m-tolylmethyl)-1,4-benzoxazin-3-one CAS Name: 4-[(3-methylphenyl)methyl]-7-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 7-(4-benzylpiperazine-1-carbonyl)-4-[(3-methylphenyl)methyl]-1,4-benzoxazin-3-one Traditional Name: 7-(4-benzylpiperazine-1-carbonyl)-4-(3-methylbenzyl)-1,4-benzoxazin-3-one Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=O)COC3=C2C=CC(=C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=O)COC3=C2C=CC(=C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c1-21-6-5-9-23(16-21)19-31-25-11-10-24(17-26(25)34-20-27(31)32)28(33)30-14-12-29(13-15-30)18-22-7-3-2-4-8-22/h2-11,16-17H,12-15,18-20H2,1H3