4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]butanoic acid

Systemtic Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]butanoic acid Openeye Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]butanoic acid CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]butanoic acid IUPAC Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]butanoic acid Traditional Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]butyric acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CN(CCCC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C13H17NO6S/c1-14(6-2-3-13(15)16)21(17,18)10-4-5-11-12(9-10)20-8-7-19-11/h4-5,9H,2-3,6-8H2,1H3,(H,15,16)