methyl (1R,2R,3S)-3-methanoyl-1,3-dimethyl-2-[2-(3-propan-2-ylphenyl)ethyl]cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2R,3S)-3-methanoyl-1,3-dimethyl-2-[2-(3-propan-2-ylphenyl)ethyl]cyclohexane-1-carboxylate Openeye Name: methyl (1R,2R,3S)-3-formyl-2-[2-(3-isopropylphenyl)ethyl]-1,3-dimethyl-cyclohexanecarboxylate CAS Name: (1R,2R,3S)-3-formyl-1,3-dimethyl-2-[2-(3-propan-2-ylphenyl)ethyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R,3S)-3-formyl-1,3-dimethyl-2-[2-(3-propan-2-ylphenyl)ethyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R,3S)-3-formyl-2-(2-m-cumenylethyl)-1,3-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1)CCC2C(CCCC2(C)C(=O)OC)(C)C=O

Isomeric SMILES

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

InChI

InChI=1S/C22H32O3/c1-16(2)18-9-6-8-17(14-18)10-11-19-21(3,15-23)12-7-13-22(19,4)20(24)25-5/h6,8-9,14-16,19H,7,10-13H2,1-5H3/t19-,21-,22-/m1/s1