3-(2-methoxycarbonylphenyl)propanethioic S-acid

Systemtic Name: 3-(2-methoxycarbonylphenyl)propanethioic S-acid Openeye Name: 3-(2-methoxycarbonylphenyl)propanethioic S-acid CAS Name: 3-(2-methoxycarbonylphenyl)propanethioic S-acid IUPAC Name: 3-(2-methoxycarbonylphenyl)propanethioic S-acid Traditional Name: 3-(2-carbomethoxyphenyl)thiopropionic acid Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CCC(=O)S

Isomeric SMILES

COC(=O)C1=CC=CC=C1CCC(=O)S

InChI

InChI=1S/C11H12O3S/c1-14-11(13)9-5-3-2-4-8(9)6-7-10(12)15/h2-5H,6-7H2,1H3,(H,12,15)