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

Systemtic Name: 6-(2-chlorophenyl)carbonyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 6-(2-chlorobenzoyl)-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 6-[(2-chlorophenyl)-oxomethyl]-3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-(2-chlorobenzoyl)-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 6-(2-chlorobenzoyl)-3-[[4-(4-nitrophenyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C25H21ClN4O5 MolecularWeight: 492.91104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4Cl)OC2=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4Cl)OC2=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H21ClN4O5/c26-21-4-2-1-3-20(21)24(31)17-5-10-22-23(15-17)35-25(32)29(22)16-27-11-13-28(14-12-27)18-6-8-19(9-7-18)30(33)34/h1-10,15H,11-14,16H2