2-methylpyridine; 4-sulfanylbenzoic acid

Systemtic Name: 2-methylpyridine; 4-sulfanylbenzoic acid Openeye Name: 2-methylpyridine; 4-sulfanylbenzoic acid CAS Name: 4-mercaptobenzoic acid; 2-methylpyridine IUPAC Name: 2-methylpyridine; 4-sulfanylbenzoic acid Traditional Name: $a-picoline; 4-mercaptobenzoic acid Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=N1.C1=CC(=CC=C1C(=O)O)S

Isomeric SMILES

CC1=CC=CC=N1.C1=CC(=CC=C1C(=O)O)S

InChI

InChI=1S/C7H6O2S.C6H7N/c8-7(9)5-1-3-6(10)4-2-5;1-6-4-2-3-5-7-6/h1-4,10H,(H,8,9);2-5H,1H3