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

Systemtic Name: ethyl 6-[4-[[2-(4-bromophenyl)phenyl]carbonylamino]piperidin-1-yl]-3-ethyl-3-phenyl-hexanoate Openeye Name: ethyl 6-[4-[[2-(4-bromophenyl)benzoyl]amino]-1-piperidyl]-3-ethyl-3-phenyl-hexanoate CAS Name: 6-[4-[[[2-(4-bromophenyl)phenyl]-oxomethyl]amino]-1-piperidinyl]-3-ethyl-3-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[4-[[2-(4-bromophenyl)benzoyl]amino]piperidin-1-yl]-3-ethyl-3-phenylhexanoate Traditional Name: 6-[4-[[2-(4-bromophenyl)benzoyl]amino]piperidino]-3-ethyl-3-phenyl-hexanoic acid ethyl ester Formula: C34H41BrN2O3 MolecularWeight: 605.60494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCN1CCC(CC1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)Br)(CC(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCC(CCCN1CCC(CC1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)Br)(CC(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C34H41BrN2O3/c1-3-34(25-32(38)40-4-2,27-11-6-5-7-12-27)21-10-22-37-23-19-29(20-24-37)36-33(39)31-14-9-8-13-30(31)26-15-17-28(35)18-16-26/h5-9,11-18,29H,3-4,10,19-25H2,1-2H3,(H,36,39)