4-azanyl-2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-(2,3-dihydrobenzofuran-5-ylsulfonylamino)-4-oxo-butanoic acid CAS Name: 4-amino-2-(2,3-dihydrobenzofuran-5-ylsulfonylamino)-4-oxobutanoic acid IUPAC Name: 4-amino-2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-4-oxobutanoic acid Traditional Name: 4-amino-2-(coumaran-5-ylsulfonylamino)-4-keto-butyric acid Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)S(=O)(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1COC2=C1C=C(C=C2)S(=O)(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C12H14N2O6S/c13-11(15)6-9(12(16)17)14-21(18,19)8-1-2-10-7(5-8)3-4-20-10/h1-2,5,9,14H,3-4,6H2,(H2,13,15)(H,16,17)