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

Systemtic Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-6-(phenylcarbonyl)-1,3-benzoxazol-2-one Openeye Name: 6-benzoyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 6-benzoyl-3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-benzoyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 6-benzoyl-3-[[4-(4-nitrophenyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)OC2=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)OC2=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O5/c30-24(18-4-2-1-3-5-18)19-6-11-22-23(16-19)34-25(31)28(22)17-26-12-14-27(15-13-26)20-7-9-21(10-8-20)29(32)33/h1-11,16H,12-15,17H2