3-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-5-methyl-6-(3-methylphenyl)carbonyl-1,3-benzoxazol-2-one

Systemtic Name: 3-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-5-methyl-6-(3-methylphenyl)carbonyl-1,3-benzoxazol-2-one Openeye Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-5-methyl-6-(3-methylbenzoyl)-1,3-benzoxazol-2-one CAS Name: 3-[[4-(4-acetylphenyl)-1-piperazinyl]methyl]-5-methyl-6-[(3-methylphenyl)-oxomethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-5-methyl-6-(3-methylbenzoyl)-1,3-benzoxazol-2-one Traditional Name: 3-[[4-(4-acetylphenyl)piperazino]methyl]-5-methyl-6-m-toluoyl-1,3-benzoxazol-2-one Formula: C29H29N3O4 MolecularWeight: 483.55826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2=CC3=C(C=C2C)N(C(=O)O3)CN4CCN(CC4)C5=CC=C(C=C5)C(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2=CC3=C(C=C2C)N(C(=O)O3)CN4CCN(CC4)C5=CC=C(C=C5)C(=O)C

InChI

InChI=1S/C29H29N3O4/c1-19-5-4-6-23(15-19)28(34)25-17-27-26(16-20(25)2)32(29(35)36-27)18-30-11-13-31(14-12-30)24-9-7-22(8-10-24)21(3)33/h4-10,15-17H,11-14,18H2,1-3H3