(2S)-2-(3,4-dimethylphenyl)propanoate

Systemtic Name: (2S)-2-(3,4-dimethylphenyl)propanoate Openeye Name: (2S)-2-(3,4-dimethylphenyl)propanoate CAS Name: (2S)-2-(3,4-dimethylphenyl)propanoate IUPAC Name: (2S)-2-(3,4-dimethylphenyl)propanoate Traditional Name: (2S)-2-(3,4-dimethylphenyl)propionate Formula: C11H13O2- MolecularWeight: 177.21972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C(=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C11H14O2/c1-7-4-5-10(6-8(7)2)9(3)11(12)13/h4-6,9H,1-3H3,(H,12,13)/p-1/t9-/m0/s1