methyl 4-chloranyl-2-sulfanyl-benzoate

Systemtic Name: methyl 4-chloranyl-2-sulfanyl-benzoate Openeye Name: methyl 4-chloro-2-sulfanyl-benzoate CAS Name: 4-chloro-2-mercaptobenzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-sulfanylbenzoate Traditional Name: 4-chloro-2-mercapto-benzoic acid methyl ester Formula: C8H7ClO2S MolecularWeight: 202.65798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)S

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)S

InChI

InChI=1S/C8H7ClO2S/c1-11-8(10)6-3-2-5(9)4-7(6)12/h2-4,12H,1H3