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

Systemtic Name: 5-[(4-nitrophenyl)carbonylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-[(4-nitrobenzoyl)amino]-2-(1-piperidyl)-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(4-nitrophenyl)-oxomethyl]amino]-2-(1-piperidinyl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-[(4-nitrobenzoyl)amino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-[(4-nitrobenzoyl)amino]-2-piperidino-N-(3-pyridylmethyl)benzamide Formula: C25H25N5O4 MolecularWeight: 459.4971

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C25H25N5O4/c31-24(19-6-9-21(10-7-19)30(33)34)28-20-8-11-23(29-13-2-1-3-14-29)22(15-20)25(32)27-17-18-5-4-12-26-16-18/h4-12,15-16H,1-3,13-14,17H2,(H,27,32)(H,28,31)