2-[(5-methoxycarbonyl-2-methyl-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(5-methoxycarbonyl-2-methyl-phenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(5-methoxycarbonyl-2-methyl-phenyl)sulfonylamino]butanoic acid CAS Name: 2-[(5-methoxycarbonyl-2-methylphenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(5-methoxycarbonyl-2-methylphenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(5-carbomethoxy-2-methyl-phenyl)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=C(C=CC(=C1)C(=O)OC)C

Isomeric SMILES

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

InChI

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