3-(2-methoxyethoxycarbonyl)-2,4-dimethyl-benzenecarbothioic S-acid

Systemtic Name: 3-(2-methoxyethoxycarbonyl)-2,4-dimethyl-benzenecarbothioic S-acid Openeye Name: 3-(2-methoxyethoxycarbonyl)-2,4-dimethyl-benzenecarbothioic S-acid CAS Name: 3-[2-methoxyethoxy(oxo)methyl]-2,4-dimethylbenzenecarbothioic S-acid IUPAC Name: 3-(2-methoxyethoxycarbonyl)-2,4-dimethylbenzenecarbothioic S-acid Traditional Name: 3-(2-methoxyethoxycarbonyl)-2,4-dimethyl-thiobenzoic acid Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4S/c1-8-4-5-10(13(15)18)9(2)11(8)12(14)17-7-6-16-3/h4-5H,6-7H2,1-3H3,(H,15,18)