1-(2-chloranylpyridin-3-yl)carbonyl-N-[2-(4-ethylphenyl)ethyl]-4-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranylpyridin-3-yl)carbonyl-N-[2-(4-ethylphenyl)ethyl]-4-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 4-benzyl-1-(2-chloropyridine-3-carbonyl)-N-[2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(2-chloro-3-pyridinyl)-oxomethyl]-N-[2-(4-ethylphenyl)ethyl]-4-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 4-benzyl-1-(2-chloropyridine-3-carbonyl)-N-[2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 4-benzyl-1-(2-chloronicotinoyl)-N-[2-(4-ethylphenyl)ethyl]isonipecotamide Formula: C29H32ClN3O2 MolecularWeight: 490.03628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCNC(=O)C2(CCN(CC2)C(=O)C3=C(N=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)CCNC(=O)C2(CCN(CC2)C(=O)C3=C(N=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C29H32ClN3O2/c1-2-22-10-12-23(13-11-22)14-18-32-28(35)29(21-24-7-4-3-5-8-24)15-19-33(20-16-29)27(34)25-9-6-17-31-26(25)30/h3-13,17H,2,14-16,18-21H2,1H3,(H,32,35)