(4-methoxyphenyl)sulfonyl 1,4-thiazonane-3-carboxylate

Systemtic Name: (4-methoxyphenyl)sulfonyl 1,4-thiazonane-3-carboxylate Openeye Name: (4-methoxyphenyl)sulfonyl 1,4-thiazonane-3-carboxylate CAS Name: 1,4-thiazonane-3-carboxylic acid (4-methoxyphenyl)sulfonyl ester IUPAC Name: (4-methoxyphenyl)sulfonyl 1,4-thiazonane-3-carboxylate Traditional Name: 1,4-thiazonane-3-carboxylic acid (4-methoxyphenyl)sulfonyl ester Formula: C15H21NO5S2 MolecularWeight: 359.46094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC(=O)C2CSCCCCCN2

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC(=O)C2CSCCCCCN2

InChI

InChI=1S/C15H21NO5S2/c1-20-12-5-7-13(8-6-12)23(18,19)21-15(17)14-11-22-10-4-2-3-9-16-14/h5-8,14,16H,2-4,9-11H2,1H3