methyl 4-azanyl-3-sulfanyl-benzoate hydrochloride

Systemtic Name: methyl 4-azanyl-3-sulfanyl-benzoate hydrochloride Openeye Name: methyl 4-amino-3-sulfanyl-benzoate hydrochloride CAS Name: 4-amino-3-mercaptobenzoic acid methyl ester hydrochloride IUPAC Name: methyl 4-amino-3-sulfanylbenzoate hydrochloride Traditional Name: 4-amino-3-mercapto-benzoic acid methyl ester hydrochloride Formula: C8H10ClNO2S MolecularWeight: 219.6885

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N)S.Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N)S.Cl

InChI

InChI=1S/C8H9NO2S.ClH/c1-11-8(10)5-2-3-6(9)7(12)4-5;/h2-4,12H,9H2,1H3;1H