methyl 8-(2-cyanophenyl)sulfanylnaphthalene-1-carboxylate

Systemtic Name: methyl 8-(2-cyanophenyl)sulfanylnaphthalene-1-carboxylate Openeye Name: methyl 8-(2-cyanophenyl)sulfanylnaphthalene-1-carboxylate CAS Name: 8-[(2-cyanophenyl)thio]-1-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 8-(2-cyanophenyl)sulfanylnaphthalene-1-carboxylate Traditional Name: 8-[(2-cyanophenyl)thio]naphthalene-1-carboxylic acid methyl ester Formula: C19H13NO2S MolecularWeight: 319.37702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC2=C1C(=CC=C2)SC3=CC=CC=C3C#N

Isomeric SMILES

COC(=O)C1=CC=CC2=C1C(=CC=C2)SC3=CC=CC=C3C#N

InChI

InChI=1S/C19H13NO2S/c1-22-19(21)15-9-4-7-13-8-5-11-17(18(13)15)23-16-10-3-2-6-14(16)12-20/h2-11H,1H3