2-[2,3-dihydro-1-benzofuran-2-yl(methanoyl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2,3-dihydro-1-benzofuran-2-yl(methanoyl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[2,3-dihydrobenzofuran-2-yl(formyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[2,3-dihydrobenzofuran-2-yl(formyl)amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[2,3-dihydro-1-benzofuran-2-yl(formyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[coumaran-2-yl(formyl)amino]-4-(methylthio)butyric acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N(C=O)C1CC2=CC=CC=C2O1

Isomeric SMILES

CSCCC(C(=O)O)N(C=O)C1CC2=CC=CC=C2O1

InChI

InChI=1S/C14H17NO4S/c1-20-7-6-11(14(17)18)15(9-16)13-8-10-4-2-3-5-12(10)19-13/h2-5,9,11,13H,6-8H2,1H3,(H,17,18)