7-[(2-ethylsulfonylphenyl)amino]heptanoic acid

Systemtic Name: 7-[(2-ethylsulfonylphenyl)amino]heptanoic acid Openeye Name: 7-(2-ethylsulfonylanilino)heptanoic acid CAS Name: 7-(2-ethylsulfonylanilino)heptanoic acid IUPAC Name: 7-(2-ethylsulfonylanilino)heptanoic acid Traditional Name: 7-(2-esylanilino)enanthic acid Formula: C15H23NO4S MolecularWeight: 313.41242

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1NCCCCCCC(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1NCCCCCCC(=O)O

InChI

InChI=1S/C15H23NO4S/c1-2-21(19,20)14-10-7-6-9-13(14)16-12-8-4-3-5-11-15(17)18/h6-7,9-10,16H,2-5,8,11-12H2,1H3,(H,17,18)