[(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-(4-methoxyphenyl)-2-oxidanylidene-ethanoate

Systemtic Name: [(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-(4-methoxyphenyl)-2-oxidanylidene-ethanoate Openeye Name: [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-(4-methoxyphenyl)-2-oxo-acetate CAS Name: 2-(4-methoxyphenyl)-2-oxoacetic acid [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-(4-methoxyphenyl)-2-oxoacetate Traditional Name: 2-keto-2-(4-methoxyphenyl)acetic acid [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C19H26O4 MolecularWeight: 318.40734

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(=O)C2=CC=C(C=C2)OC)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@H](C1)OC(=O)C(=O)C2=CC=C(C=C2)OC)C(C)C

InChI

InChI=1S/C19H26O4/c1-12(2)16-10-5-13(3)11-17(16)23-19(21)18(20)14-6-8-15(22-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3/t13-,16+,17+/m1/s1