5-[(4-nitrophenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-[(4-nitrophenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-[(4-nitrobenzoyl)amino]-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(4-nitrophenyl)-oxomethyl]amino]-2-[4-(phenylmethyl)-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-[(4-nitrobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-[(4-nitrobenzoyl)amino]-N-(3-pyridylmethyl)benzamide Formula: C32H31N5O4 MolecularWeight: 549.61964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C32H31N5O4/c38-31(26-8-11-28(12-9-26)37(40)41)35-27-10-13-30(29(20-27)32(39)34-22-25-7-4-16-33-21-25)36-17-14-24(15-18-36)19-23-5-2-1-3-6-23/h1-13,16,20-21,24H,14-15,17-19,22H2,(H,34,39)(H,35,38)