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

Systemtic Name: 5-[(3-nitrophenyl)carbonylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-[(3-nitrobenzoyl)amino]-2-(1-piperidyl)-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(3-nitrophenyl)-oxomethyl]amino]-2-(1-piperidinyl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-[(3-nitrobenzoyl)amino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-[(3-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(=CC=C3)[N+](=O)[O-])C(=O)NCC4=CN=CC=C4

Isomeric SMILES

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

InChI

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