5-(4-ethanoylphenyl)-2-(octylsulfonylamino)benzoic acid

Systemtic Name: 5-(4-ethanoylphenyl)-2-(octylsulfonylamino)benzoic acid Openeye Name: 5-(4-acetylphenyl)-2-(octylsulfonylamino)benzoic acid CAS Name: 5-(4-acetylphenyl)-2-(octylsulfonylamino)benzoic acid IUPAC Name: 5-(4-acetylphenyl)-2-(octylsulfonylamino)benzoic acid Traditional Name: 5-(4-acetylphenyl)-2-(octylsulfonylamino)benzoic acid Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)NC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)C)C(=O)O

Isomeric SMILES

CCCCCCCCS(=O)(=O)NC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)C)C(=O)O

InChI

InChI=1S/C23H29NO5S/c1-3-4-5-6-7-8-15-30(28,29)24-22-14-13-20(16-21(22)23(26)27)19-11-9-18(10-12-19)17(2)25/h9-14,16,24H,3-8,15H2,1-2H3,(H,26,27)