octyl 2,6-dimethyl-5-(methylsulfonylamino)-1-benzofuran-3-carboxylate

Systemtic Name: octyl 2,6-dimethyl-5-(methylsulfonylamino)-1-benzofuran-3-carboxylate Openeye Name: octyl 5-(methanesulfonamido)-2,6-dimethyl-benzofuran-3-carboxylate CAS Name: 5-(methanesulfonamido)-2,6-dimethyl-3-benzofurancarboxylic acid octyl ester IUPAC Name: octyl 5-(methanesulfonamido)-2,6-dimethyl-1-benzofuran-3-carboxylate Traditional Name: 5-(methanesulfonamido)-2,6-dimethyl-benzofuran-3-carboxylic acid octyl ester Formula: C20H29NO5S MolecularWeight: 395.51296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C)C)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C)C)C

InChI

InChI=1S/C20H29NO5S/c1-5-6-7-8-9-10-11-25-20(22)19-15(3)26-18-12-14(2)17(13-16(18)19)21-27(4,23)24/h12-13,21H,5-11H2,1-4H3