[(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-methoxy-5-methyl-benzoate

Systemtic Name: [(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-methoxy-5-methyl-benzoate Openeye Name: [(1R)-2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2-methoxy-5-methyl-benzoate CAS Name: 2-methoxy-5-methylbenzoic acid [(2R)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] 2-methoxy-5-methylbenzoate Traditional Name: 2-methoxy-5-methyl-benzoic acid [(1R)-2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C20H22O4 MolecularWeight: 326.38628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)OC(C)C(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)O[C@H](C)C(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H22O4/c1-12-6-9-18(23-5)17(10-12)20(22)24-15(4)19(21)16-8-7-13(2)14(3)11-16/h6-11,15H,1-5H3/t15-/m1/s1