methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-(2-thienyl)propanoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-thiophen-2-ylpropanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-(2-thienyl)propionic acid methyl ester Formula: C16H17NO6S2 MolecularWeight: 383.43928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H17NO6S2/c1-21-16(18)10-12(15-3-2-8-24-15)17-25(19,20)11-4-5-13-14(9-11)23-7-6-22-13/h2-5,8-9,12,17H,6-7,10H2,1H3