5-(3-hydroxyphenyl)-2-(octylsulfonylamino)benzoic acid

Systemtic Name: 5-(3-hydroxyphenyl)-2-(octylsulfonylamino)benzoic acid Openeye Name: 5-(3-hydroxyphenyl)-2-(octylsulfonylamino)benzoic acid CAS Name: 5-(3-hydroxyphenyl)-2-(octylsulfonylamino)benzoic acid IUPAC Name: 5-(3-hydroxyphenyl)-2-(octylsulfonylamino)benzoic acid Traditional Name: 5-(3-hydroxyphenyl)-2-(octylsulfonylamino)benzoic acid Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO5S/c1-2-3-4-5-6-7-13-28(26,27)22-20-12-11-17(15-19(20)21(24)25)16-9-8-10-18(23)14-16/h8-12,14-15,22-23H,2-7,13H2,1H3,(H,24,25)