4-(4-ethanoylpiperazin-1-yl)-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[[4-(1-imidazolylmethyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-[4-(imidazol-1-ylmethyl)benzyl]-3-nitro-benzamide Formula: C24H26N6O4 MolecularWeight: 462.50104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H26N6O4/c1-18(31)28-10-12-29(13-11-28)22-7-6-21(14-23(22)30(33)34)24(32)26-15-19-2-4-20(5-3-19)16-27-9-8-25-17-27/h2-9,14,17H,10-13,15-16H2,1H3,(H,26,32)