N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-homoveratryl-1-(2-nitrophenyl)isonipecotamide Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])OC

InChI

InChI=1S/C22H27N3O5/c1-29-20-8-7-16(15-21(20)30-2)9-12-23-22(26)17-10-13-24(14-11-17)18-5-3-4-6-19(18)25(27)28/h3-8,15,17H,9-14H2,1-2H3,(H,23,26)