methyl (3R)-3-(3,4-dimethylphenyl)-2-oxidanylidene-butanoate

Systemtic Name: methyl (3R)-3-(3,4-dimethylphenyl)-2-oxidanylidene-butanoate Openeye Name: methyl (3R)-3-(3,4-dimethylphenyl)-2-oxo-butanoate CAS Name: (3R)-3-(3,4-dimethylphenyl)-2-oxobutanoic acid methyl ester IUPAC Name: methyl (3R)-3-(3,4-dimethylphenyl)-2-oxobutanoate Traditional Name: (3R)-3-(3,4-dimethylphenyl)-2-keto-butyric acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-8-5-6-11(7-9(8)2)10(3)12(14)13(15)16-4/h5-7,10H,1-4H3/t10-/m1/s1