methyl 3-sulfanylnaphthalene-1-carboxylate

Systemtic Name: methyl 3-sulfanylnaphthalene-1-carboxylate Openeye Name: methyl 3-sulfanylnaphthalene-1-carboxylate CAS Name: 3-mercapto-1-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 3-sulfanylnaphthalene-1-carboxylate Traditional Name: 3-mercaptonaphthalene-1-carboxylic acid methyl ester Formula: C12H10O2S MolecularWeight: 218.2716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC2=CC=CC=C21)S

Isomeric SMILES

COC(=O)C1=CC(=CC2=CC=CC=C21)S

InChI

InChI=1S/C12H10O2S/c1-14-12(13)11-7-9(15)6-8-4-2-3-5-10(8)11/h2-7,15H,1H3