7-[(4-ethylsulfonylphenyl)amino]heptanoic acid

Systemtic Name: 7-[(4-ethylsulfonylphenyl)amino]heptanoic acid Openeye Name: 7-(4-ethylsulfonylanilino)heptanoic acid CAS Name: 7-(4-ethylsulfonylanilino)heptanoic acid IUPAC Name: 7-(4-ethylsulfonylanilino)heptanoic acid Traditional Name: 7-(4-esylanilino)enanthic acid Formula: C15H23NO4S MolecularWeight: 313.41242

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NCCCCCCC(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NCCCCCCC(=O)O

InChI

InChI=1S/C15H23NO4S/c1-2-21(19,20)14-10-8-13(9-11-14)16-12-6-4-3-5-7-15(17)18/h8-11,16H,2-7,12H2,1H3,(H,17,18)