5-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-N-phenethyl-2-piperidin-1-yl-benzamide

Systemtic Name: 5-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-N-phenethyl-2-piperidin-1-yl-benzamide Openeye Name: 5-[(2-chloro-4-nitro-benzoyl)amino]-N-phenethyl-2-(1-piperidyl)benzamide CAS Name: 5-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-N-phenethyl-2-(1-piperidinyl)benzamide IUPAC Name: 5-[(2-chloro-4-nitrobenzoyl)amino]-N-phenethyl-2-piperidin-1-ylbenzamide Traditional Name: 5-[(2-chloro-4-nitro-benzoyl)amino]-N-phenethyl-2-piperidino-benzamide Formula: C27H27ClN4O4 MolecularWeight: 506.98068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H27ClN4O4/c28-24-18-21(32(35)36)10-11-22(24)27(34)30-20-9-12-25(31-15-5-2-6-16-31)23(17-20)26(33)29-14-13-19-7-3-1-4-8-19/h1,3-4,7-12,17-18H,2,5-6,13-16H2,(H,29,33)(H,30,34)