4-[(2-ethylsulfonylphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-[(2-ethylsulfonylphenyl)carbonylamino]butanoic acid Openeye Name: 4-[(2-ethylsulfonylbenzoyl)amino]butanoic acid CAS Name: 4-[[(2-ethylsulfonylphenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(2-ethylsulfonylbenzoyl)amino]butanoic acid Traditional Name: 4-[(2-esylbenzoyl)amino]butyric acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)NCCCC(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)NCCCC(=O)O

InChI

InChI=1S/C13H17NO5S/c1-2-20(18,19)11-7-4-3-6-10(11)13(17)14-9-5-8-12(15)16/h3-4,6-7H,2,5,8-9H2,1H3,(H,14,17)(H,15,16)