2-[(4-ethoxycarbonylphenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(4-ethoxycarbonylphenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(4-ethoxycarbonylphenyl)sulfonylamino]butanoic acid CAS Name: 2-[(4-ethoxycarbonylphenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(4-ethoxycarbonylphenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(4-carbethoxyphenyl)sulfonylamino]butyric acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C13H17NO6S/c1-3-11(12(15)16)14-21(18,19)10-7-5-9(6-8-10)13(17)20-4-2/h5-8,11,14H,3-4H2,1-2H3,(H,15,16)