ethyl 3-ethyl-6-[4-[[2-(4-ethylphenyl)phenyl]carbonylamino]piperidin-1-yl]-3-phenyl-hexanoate

Systemtic Name: ethyl 3-ethyl-6-[4-[[2-(4-ethylphenyl)phenyl]carbonylamino]piperidin-1-yl]-3-phenyl-hexanoate Openeye Name: ethyl 3-ethyl-6-[4-[[2-(4-ethylphenyl)benzoyl]amino]-1-piperidyl]-3-phenyl-hexanoate CAS Name: 3-ethyl-6-[4-[[[2-(4-ethylphenyl)phenyl]-oxomethyl]amino]-1-piperidinyl]-3-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 3-ethyl-6-[4-[[2-(4-ethylphenyl)benzoyl]amino]piperidin-1-yl]-3-phenylhexanoate Traditional Name: 3-ethyl-6-[4-[[2-(4-ethylphenyl)benzoyl]amino]piperidino]-3-phenyl-hexanoic acid ethyl ester Formula: C36H46N2O3 MolecularWeight: 554.76204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H46N2O3/c1-4-28-17-19-29(20-18-28)32-15-10-11-16-33(32)35(40)37-31-21-25-38(26-22-31)24-12-23-36(5-2,27-34(39)41-6-3)30-13-8-7-9-14-30/h7-11,13-20,31H,4-6,12,21-27H2,1-3H3,(H,37,40)