[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2S,5R)-2-acetamido-3,5-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2S,5R)-2-acetamido-3,5-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (1S,2S,5R)-2-acetamido-3,5-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,2S,5R)-2-acetamido-3,5-dimethyl-1-cyclohex-3-enecarboxylic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (1S,2S,5R)-2-acetamido-3,5-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,2S,5R)-2-acetamido-3,5-dimethyl-cyclohex-3-ene-1-carboxylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C21H35NO3 MolecularWeight: 349.5075

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CC(C=C(C2NC(=O)C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H]2C[C@H](C=C([C@H]2NC(=O)C)C)C)C(C)C

InChI

InChI=1S/C21H35NO3/c1-12(2)17-8-7-13(3)11-19(17)25-21(24)18-10-14(4)9-15(5)20(18)22-16(6)23/h9,12-14,17-20H,7-8,10-11H2,1-6H3,(H,22,23)/t13-,14+,17+,18+,19-,20-/m1/s1