(2R)-3-(3,4-dimethylphenyl)-2-sulfanyl-propanoate

Systemtic Name: (2R)-3-(3,4-dimethylphenyl)-2-sulfanyl-propanoate Openeye Name: (2R)-3-(3,4-dimethylphenyl)-2-sulfanyl-propanoate CAS Name: (2R)-3-(3,4-dimethylphenyl)-2-mercaptopropanoate IUPAC Name: (2R)-3-(3,4-dimethylphenyl)-2-sulfanylpropanoate Traditional Name: (2R)-3-(3,4-dimethylphenyl)-2-mercapto-propionate Formula: C11H13O2S- MolecularWeight: 209.28472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O2S/c1-7-3-4-9(5-8(7)2)6-10(14)11(12)13/h3-5,10,14H,6H2,1-2H3,(H,12,13)/p-1/t10-/m1/s1