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

Systemtic Name: 5-chloranyl-3-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-6-(phenylcarbonyl)-1,3-benzoxazol-2-one Openeye Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-6-benzoyl-5-chloro-1,3-benzoxazol-2-one CAS Name: 3-[[4-(4-acetylphenyl)-1-piperazinyl]methyl]-6-benzoyl-5-chloro-1,3-benzoxazol-2-one IUPAC Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-6-benzoyl-5-chloro-1,3-benzoxazol-2-one Traditional Name: 3-[[4-(4-acetylphenyl)piperazino]methyl]-6-benzoyl-5-chloro-1,3-benzoxazol-2-one Formula: C27H24ClN3O4 MolecularWeight: 489.95016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CN3C4=C(C=C(C(=C4)Cl)C(=O)C5=CC=CC=C5)OC3=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CN3C4=C(C=C(C(=C4)Cl)C(=O)C5=CC=CC=C5)OC3=O

InChI

InChI=1S/C27H24ClN3O4/c1-18(32)19-7-9-21(10-8-19)30-13-11-29(12-14-30)17-31-24-16-23(28)22(15-25(24)35-27(31)34)26(33)20-5-3-2-4-6-20/h2-10,15-16H,11-14,17H2,1H3