N-(2-methyl-5-nitro-phenyl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-yl)-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazinyl)-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-(4-benzoylpiperazino)-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O4/c1-15-7-8-17(24(27)28)13-18(15)21-19(25)14-22-9-11-23(12-10-22)20(26)16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H,21,25)