N-(3-acetamidophenyl)-5-nitro-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: N-(3-acetamidophenyl)-5-nitro-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: N-(3-acetamidophenyl)-2-(4-benzyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-(3-acetamidophenyl)-5-nitro-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: N-(3-acetamidophenyl)-2-(4-benzylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-(3-acetamidophenyl)-2-(4-benzylpiperidino)-5-nitro-benzamide Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O4/c1-19(32)28-22-8-5-9-23(17-22)29-27(33)25-18-24(31(34)35)10-11-26(25)30-14-12-21(13-15-30)16-20-6-3-2-4-7-20/h2-11,17-18,21H,12-16H2,1H3,(H,28,32)(H,29,33)