ethyl 5-oxidanylidene-1-(phenylsulfonyl)azocane-4-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-1-(phenylsulfonyl)azocane-4-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)-5-oxo-azocane-4-carboxylate CAS Name: 1-(benzenesulfonyl)-5-oxo-4-azocanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)-5-oxoazocane-4-carboxylate Traditional Name: 1-besyl-5-keto-azocane-4-carboxylic acid ethyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CCCC1=O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCN(CCCC1=O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H21NO5S/c1-2-22-16(19)14-10-12-17(11-6-9-15(14)18)23(20,21)13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3