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

Systemtic Name: 6-(2-chlorophenyl)carbonyl-3-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-5-methyl-1,3-benzoxazol-2-one Openeye Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-6-(2-chlorobenzoyl)-5-methyl-1,3-benzoxazol-2-one CAS Name: 3-[[4-(4-acetylphenyl)-1-piperazinyl]methyl]-6-[(2-chlorophenyl)-oxomethyl]-5-methyl-1,3-benzoxazol-2-one IUPAC Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-6-(2-chlorobenzoyl)-5-methyl-1,3-benzoxazol-2-one Traditional Name: 3-[[4-(4-acetylphenyl)piperazino]methyl]-6-(2-chlorobenzoyl)-5-methyl-1,3-benzoxazol-2-one Formula: C28H26ClN3O4 MolecularWeight: 503.97674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)C3=CC=CC=C3Cl)OC(=O)N2CN4CCN(CC4)C5=CC=C(C=C5)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)C3=CC=CC=C3Cl)OC(=O)N2CN4CCN(CC4)C5=CC=C(C=C5)C(=O)C

InChI

InChI=1S/C28H26ClN3O4/c1-18-15-25-26(16-23(18)27(34)22-5-3-4-6-24(22)29)36-28(35)32(25)17-30-11-13-31(14-12-30)21-9-7-20(8-10-21)19(2)33/h3-10,15-16H,11-14,17H2,1-2H3