N-cyclopropyl-4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: N-cyclopropyl-4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(phenylmethyl)benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-benzyl-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-cyclopropyl-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-benzyl-N-cyclopropyl-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-benzyl-N-cyclopropyl-3-nitro-benzamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c1-17(28)24-11-13-25(14-12-24)21-10-7-19(15-22(21)27(30)31)23(29)26(20-8-9-20)16-18-5-3-2-4-6-18/h2-7,10,15,20H,8-9,11-14,16H2,1H3