4-(4-ethanoylpiperazin-1-yl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3-nitro-benzamide Formula: C25H28N6O5 MolecularWeight: 492.52702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N6O5/c1-17(32)29-12-14-30(15-13-29)21-9-6-19(16-22(21)31(34)35)25(33)27-23(24-26-10-11-28(24)2)18-4-7-20(36-3)8-5-18/h4-11,16,23H,12-15H2,1-3H3,(H,27,33)