4-[(3-ethoxycarbonylphenyl)sulfamoyl]butanoic acid

Systemtic Name: 4-[(3-ethoxycarbonylphenyl)sulfamoyl]butanoic acid Openeye Name: 4-[(3-ethoxycarbonylphenyl)sulfamoyl]butanoic acid CAS Name: 4-[(3-ethoxycarbonylphenyl)sulfamoyl]butanoic acid IUPAC Name: 4-[(3-ethoxycarbonylphenyl)sulfamoyl]butanoic acid Traditional Name: 4-[(3-carbethoxyphenyl)sulfamoyl]butyric acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)CCCC(=O)O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)CCCC(=O)O

InChI

InChI=1S/C13H17NO6S/c1-2-20-13(17)10-5-3-6-11(9-10)14-21(18,19)8-4-7-12(15)16/h3,5-6,9,14H,2,4,7-8H2,1H3,(H,15,16)