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

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2S)-2-benzamido-2-methyl-butanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (2S)-2-benzamido-2-methyl-butanoate CAS Name: (2S)-2-benzamido-2-methylbutanoic 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-methylbutanoate Traditional Name: (2S)-2-benzamido-2-methyl-butyric acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C28H37NO3 MolecularWeight: 435.59828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OC1CC(CCC1C(C)(C)C2=CC=CC=C2)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC[C@@](C)(C(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)(C)C2=CC=CC=C2)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H37NO3/c1-6-28(5,29-25(30)21-13-9-7-10-14-21)26(31)32-24-19-20(2)17-18-23(24)27(3,4)22-15-11-8-12-16-22/h7-16,20,23-24H,6,17-19H2,1-5H3,(H,29,30)/t20-,23-,24-,28+/m1/s1