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

Systemtic Name: 6-[4-[[2-(4-bromophenyl)phenyl]carbonylamino]piperidin-1-yl]-3-methyl-3-phenyl-hexanoate Openeye Name: 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-phenylhexanoate IUPAC Name: 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-hexanoate Formula: C31H34BrN2O3- MolecularWeight: 562.51726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN1CCC(CC1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)Br)(CC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC(CCCN1CCC(CC1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)Br)(CC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C31H35BrN2O3/c1-31(22-29(35)36,24-8-3-2-4-9-24)18-7-19-34-20-16-26(17-21-34)33-30(37)28-11-6-5-10-27(28)23-12-14-25(32)15-13-23/h2-6,8-15,26H,7,16-22H2,1H3,(H,33,37)(H,35,36)/p-1