1-[(4-aminocarbonyl-2-nitro-phenyl)methyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[(4-aminocarbonyl-2-nitro-phenyl)methyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[(4-carbamoyl-2-nitro-phenyl)methyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[(4-carbamoyl-2-nitrophenyl)methyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[(4-carbamoyl-2-nitrophenyl)methyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-(4-carbamoyl-2-nitro-benzyl)-N-phenyl-nipecotamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O4/c21-19(25)14-8-9-15(18(11-14)24(27)28)12-23-10-4-5-16(13-23)20(26)22-17-6-2-1-3-7-17/h1-3,6-9,11,16H,4-5,10,12-13H2,(H2,21,25)(H,22,26)