N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-1-(2-nitrophenyl)isonipecotamide Formula: C26H28N4O4 MolecularWeight: 460.52492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C26H28N4O4/c1-18-7-8-19(2)24(15-18)34-25-10-9-20(16-27-25)17-28-26(31)21-11-13-29(14-12-21)22-5-3-4-6-23(22)30(32)33/h3-10,15-16,21H,11-14,17H2,1-2H3,(H,28,31)