[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (Z)-2-benzamidobut-2-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (Z)-2-benzamidobut-2-enoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (Z)-2-benzamidobut-2-enoate CAS Name: (Z)-2-benzamido-2-butenoic 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] (Z)-2-benzamidobut-2-enoate Traditional Name: (Z)-2-benzamidobut-2-enoic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C27H33NO3 MolecularWeight: 419.55582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/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/C27H33NO3/c1-5-23(28-25(29)20-12-8-6-9-13-20)26(30)31-24-18-19(2)16-17-22(24)27(3,4)21-14-10-7-11-15-21/h5-15,19,22,24H,16-18H2,1-4H3,(H,28,29)/b23-5-/t19-,22-,24-/m1/s1