3-methoxycarbonyl-2,4-dimethyl-benzenecarbothioic S-acid

Systemtic Name: 3-methoxycarbonyl-2,4-dimethyl-benzenecarbothioic S-acid Openeye Name: 3-methoxycarbonyl-2,4-dimethyl-benzenecarbothioic S-acid CAS Name: 3-methoxycarbonyl-2,4-dimethylbenzenecarbothioic S-acid IUPAC Name: 3-methoxycarbonyl-2,4-dimethylbenzenecarbothioic S-acid Traditional Name: 3-carbomethoxy-2,4-dimethyl-thiobenzoic acid Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O3S/c1-6-4-5-8(11(13)15)7(2)9(6)10(12)14-3/h4-5H,1-3H3,(H,13,15)