6-[4-[[2-(4-ethylphenyl)phenyl]carbonylamino]piperidin-1-yl]-3-methyl-3-phenyl-hexanoic acid

Systemtic Name: 6-[4-[[2-(4-ethylphenyl)phenyl]carbonylamino]piperidin-1-yl]-3-methyl-3-phenyl-hexanoic acid Openeye Name: 6-[4-[[2-(4-ethylphenyl)benzoyl]amino]-1-piperidyl]-3-methyl-3-phenyl-hexanoic acid CAS Name: 6-[4-[[[2-(4-ethylphenyl)phenyl]-oxomethyl]amino]-1-piperidinyl]-3-methyl-3-phenylhexanoic acid IUPAC Name: 6-[4-[[2-(4-ethylphenyl)benzoyl]amino]piperidin-1-yl]-3-methyl-3-phenylhexanoic acid Traditional Name: 6-[4-[[2-(4-ethylphenyl)benzoyl]amino]piperidino]-3-methyl-3-phenyl-hexanoic acid Formula: C33H40N2O3 MolecularWeight: 512.6823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3CCN(CC3)CCCC(C)(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3CCN(CC3)CCCC(C)(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C33H40N2O3/c1-3-25-14-16-26(17-15-25)29-12-7-8-13-30(29)32(38)34-28-18-22-35(23-19-28)21-9-20-33(2,24-31(36)37)27-10-5-4-6-11-27/h4-8,10-17,28H,3,9,18-24H2,1-2H3,(H,34,38)(H,36,37)