2-[[2-cyclohexyl-2-(4-quinolin-8-ylphenyl)ethyl]-(phenylmethyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-cyclohexyl-2-(4-quinolin-8-ylphenyl)ethyl]-(phenylmethyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[benzyl-[2-cyclohexyl-2-[4-(8-quinolyl)phenyl]ethyl]amino]-2-oxo-acetic acid CAS Name: 2-[[2-cyclohexyl-2-[4-(8-quinolinyl)phenyl]ethyl]-(phenylmethyl)amino]-2-oxoacetic acid IUPAC Name: 2-[benzyl-[2-cyclohexyl-2-(4-quinolin-8-ylphenyl)ethyl]amino]-2-oxoacetic acid Traditional Name: 2-[benzyl-[2-cyclohexyl-2-[4-(8-quinolyl)phenyl]ethyl]amino]-2-keto-acetic acid Formula: C32H32N2O3 MolecularWeight: 492.60808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CN(CC2=CC=CC=C2)C(=O)C(=O)O)C3=CC=C(C=C3)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CCC(CC1)C(CN(CC2=CC=CC=C2)C(=O)C(=O)O)C3=CC=C(C=C3)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C32H32N2O3/c35-31(32(36)37)34(21-23-9-3-1-4-10-23)22-29(24-11-5-2-6-12-24)26-18-16-25(17-19-26)28-15-7-13-27-14-8-20-33-30(27)28/h1,3-4,7-10,13-20,24,29H,2,5-6,11-12,21-22H2,(H,36,37)