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

Systemtic Name: ethyl 6-[4-[[2-(4-bromophenyl)phenyl]carbonylamino]piperidin-1-yl]-3-methyl-3-phenyl-hexanoate Openeye Name: ethyl 6-[4-[[2-(4-bromophenyl)benzoyl]amino]-1-piperidyl]-3-methyl-3-phenyl-hexanoate CAS Name: 6-[4-[[[2-(4-bromophenyl)phenyl]-oxomethyl]amino]-1-piperidinyl]-3-methyl-3-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[4-[[2-(4-bromophenyl)benzoyl]amino]piperidin-1-yl]-3-methyl-3-phenylhexanoate Traditional Name: 6-[4-[[2-(4-bromophenyl)benzoyl]amino]piperidino]-3-methyl-3-phenyl-hexanoic acid ethyl ester Formula: C33H39BrN2O3 MolecularWeight: 591.57836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H39BrN2O3/c1-3-39-31(37)24-33(2,26-10-5-4-6-11-26)20-9-21-36-22-18-28(19-23-36)35-32(38)30-13-8-7-12-29(30)25-14-16-27(34)17-15-25/h4-8,10-17,28H,3,9,18-24H2,1-2H3,(H,35,38)