(3R)-1-[1-(2,6-diphenylpyridin-4-yl)carbonylpiperidin-4-yl]piperidine-3-carboxylic acid

Systemtic Name: (3R)-1-[1-(2,6-diphenylpyridin-4-yl)carbonylpiperidin-4-yl]piperidine-3-carboxylic acid Openeye Name: (3R)-1-[1-(2,6-diphenylpyridine-4-carbonyl)-4-piperidyl]piperidine-3-carboxylic acid CAS Name: (3R)-1-[1-[(2,6-diphenyl-4-pyridinyl)-oxomethyl]-4-piperidinyl]-3-piperidinecarboxylic acid IUPAC Name: (3R)-1-[1-(2,6-diphenylpyridine-4-carbonyl)piperidin-4-yl]piperidine-3-carboxylic acid Traditional Name: (3R)-1-[1-(2,6-diphenylisonicotinoyl)-4-piperidyl]nipecotic acid Formula: C29H31N3O3 MolecularWeight: 469.57474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CCN(CC2)C(=O)C3=CC(=NC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C[C@H](CN(C1)C2CCN(CC2)C(=O)C3=CC(=NC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C29H31N3O3/c33-28(31-16-13-25(14-17-31)32-15-7-12-23(20-32)29(34)35)24-18-26(21-8-3-1-4-9-21)30-27(19-24)22-10-5-2-6-11-22/h1-6,8-11,18-19,23,25H,7,12-17,20H2,(H,34,35)/t23-/m1/s1