4-(2-hydroxyethyl)-3-methyl-benzenecarbothioic S-acid

Systemtic Name: 4-(2-hydroxyethyl)-3-methyl-benzenecarbothioic S-acid Openeye Name: 4-(2-hydroxyethyl)-3-methyl-benzenecarbothioic S-acid CAS Name: 4-(2-hydroxyethyl)-3-methylbenzenecarbothioic S-acid IUPAC Name: 4-(2-hydroxyethyl)-3-methylbenzenecarbothioic S-acid Traditional Name: 4-(2-hydroxyethyl)-3-methyl-thiobenzoic acid Formula: C10H12O2S MolecularWeight: 196.26608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)S)CCO

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)S)CCO

InChI

InChI=1S/C10H12O2S/c1-7-6-9(10(12)13)3-2-8(7)4-5-11/h2-3,6,11H,4-5H2,1H3,(H,12,13)