N-[(2R)-2-benzamidocyclohexyl]-1-(4-methyl-3-nitro-phenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methyl-3-nitro-phenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methyl-3-nitro-benzoyl)piperidine-3-carboxamide CAS Name: N-[(2R)-2-benzamidocyclohexyl]-1-[(4-methyl-3-nitrophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methyl-3-nitrobenzoyl)piperidine-3-carboxamide Traditional Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methyl-3-nitro-benzoyl)nipecotamide Formula: C27H32N4O5 MolecularWeight: 492.56678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3CCCCC3NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3CCCC[C@H]3NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H32N4O5/c1-18-13-14-20(16-24(18)31(35)36)27(34)30-15-7-10-21(17-30)26(33)29-23-12-6-5-11-22(23)28-25(32)19-8-3-2-4-9-19/h2-4,8-9,13-14,16,21-23H,5-7,10-12,15,17H2,1H3,(H,28,32)(H,29,33)/t21?,22-,23?/m1/s1