methyl N-[(5R)-3,3-dimethyl-5-[2-(3-methylphenyl)ethynyl]-5-oxidanyl-cyclohexyl]-N-methyl-carbamate

Systemtic Name: methyl N-[(5R)-3,3-dimethyl-5-[2-(3-methylphenyl)ethynyl]-5-oxidanyl-cyclohexyl]-N-methyl-carbamate Openeye Name: methyl N-[(3R)-3-hydroxy-5,5-dimethyl-3-[2-(m-tolyl)ethynyl]cyclohexyl]-N-methyl-carbamate CAS Name: N-[(3R)-3-hydroxy-5,5-dimethyl-3-[2-(3-methylphenyl)ethynyl]cyclohexyl]-N-methylcarbamic acid methyl ester IUPAC Name: methyl N-[(3R)-3-hydroxy-5,5-dimethyl-3-[2-(3-methylphenyl)ethynyl]cyclohexyl]-N-methylcarbamate Traditional Name: N-[(3R)-3-hydroxy-5,5-dimethyl-3-[2-(m-tolyl)ethynyl]cyclohexyl]-N-methyl-carbamic acid methyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C#CC2(CC(CC(C2)(C)C)N(C)C(=O)OC)O

Isomeric SMILES

CC1=CC=CC(=C1)C#C[C@@]2(CC(CC(C2)(C)C)N(C)C(=O)OC)O

InChI

InChI=1S/C20H27NO3/c1-15-7-6-8-16(11-15)9-10-20(23)13-17(12-19(2,3)14-20)21(4)18(22)24-5/h6-8,11,17,23H,12-14H2,1-5H3/t17?,20-/m0/s1