[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-benzamido-4-phenylmethoxy-2-(phenylmethyl)butanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-benzamido-4-phenylmethoxy-2-(phenylmethyl)butanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-benzamido-2-benzyl-4-benzyloxy-butanoate CAS Name: 2-benzamido-4-phenylmethoxy-2-(phenylmethyl)butanoic 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] 2-benzamido-2-benzyl-4-phenylmethoxybutanoate Traditional Name: 2-benzamido-4-benzoxy-2-benzyl-butyric acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C41H47NO4 MolecularWeight: 617.81618

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(CCOCC2=CC=CC=C2)(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C(C)(C)C5=CC=CC=C5

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(CCOCC2=CC=CC=C2)(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C(C)(C)C5=CC=CC=C5

InChI

InChI=1S/C41H47NO4/c1-31-24-25-36(40(2,3)35-22-14-7-15-23-35)37(28-31)46-39(44)41(29-32-16-8-4-9-17-32,42-38(43)34-20-12-6-13-21-34)26-27-45-30-33-18-10-5-11-19-33/h4-23,31,36-37H,24-30H2,1-3H3,(H,42,43)/t31-,36-,37-,41?/m1/s1