ethyl 3-cyano-3-(phenylsulfonyl)-1,2-dihydroindene-1-carboxylate

Systemtic Name: ethyl 3-cyano-3-(phenylsulfonyl)-1,2-dihydroindene-1-carboxylate Openeye Name: ethyl 3-(benzenesulfonyl)-3-cyano-indane-1-carboxylate CAS Name: 3-(benzenesulfonyl)-3-cyano-1,2-dihydroindene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(benzenesulfonyl)-3-cyano-1,2-dihydroindene-1-carboxylate Traditional Name: 3-besyl-3-cyano-indane-1-carboxylic acid ethyl ester Formula: C19H17NO4S MolecularWeight: 355.40758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C2=CC=CC=C12)(C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CC(C2=CC=CC=C12)(C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H17NO4S/c1-2-24-18(21)16-12-19(13-20,17-11-7-6-10-15(16)17)25(22,23)14-8-4-3-5-9-14/h3-11,16H,2,12H2,1H3