[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2S)-2-benzamido-2-methyl-3-phenyl-propanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2S)-2-benzamido-2-methyl-3-phenyl-propanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (2S)-2-benzamido-2-methyl-3-phenyl-propanoate CAS Name: (2S)-2-benzamido-2-methyl-3-phenylpropanoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2S)-2-benzamido-2-methyl-3-phenylpropanoate Traditional Name: (2S)-2-benzamido-2-methyl-3-phenyl-propionic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C33H39NO3 MolecularWeight: 497.66766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C)(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@](C)(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C33H39NO3/c1-24-20-21-28(32(2,3)27-18-12-7-13-19-27)29(22-24)37-31(36)33(4,23-25-14-8-5-9-15-25)34-30(35)26-16-10-6-11-17-26/h5-19,24,28-29H,20-23H2,1-4H3,(H,34,35)/t24-,28-,29-,33+/m1/s1