methyl 2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-3-methyl-butanoate

Systemtic Name: methyl 2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-3-methyl-butanoate Openeye Name: methyl 2-(2,3-dihydrobenzofuran-5-ylsulfonylamino)-3-methyl-butanoate CAS Name: 2-(2,3-dihydrobenzofuran-5-ylsulfonylamino)-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-3-methylbutanoate Traditional Name: 2-(coumaran-5-ylsulfonylamino)-3-methyl-butyric acid methyl ester Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC2=C(C=C1)OCC2

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC2=C(C=C1)OCC2

InChI

InChI=1S/C14H19NO5S/c1-9(2)13(14(16)19-3)15-21(17,18)11-4-5-12-10(8-11)6-7-20-12/h4-5,8-9,13,15H,6-7H2,1-3H3