4-(4-ethanoylpiperazin-1-yl)-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-isobutyl-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-isobutyl-3-nitro-benzamide Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O4/c1-12(2)11-18-17(23)14-4-5-15(16(10-14)21(24)25)20-8-6-19(7-9-20)13(3)22/h4-5,10,12H,6-9,11H2,1-3H3,(H,18,23)