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

Systemtic Name: 5-(4-methoxyphenyl)-2-(octylsulfonylamino)benzoic acid Openeye Name: 5-(4-methoxyphenyl)-2-(octylsulfonylamino)benzoic acid CAS Name: 5-(4-methoxyphenyl)-2-(octylsulfonylamino)benzoic acid IUPAC Name: 5-(4-methoxyphenyl)-2-(octylsulfonylamino)benzoic acid Traditional Name: 5-(4-methoxyphenyl)-2-(octylsulfonylamino)benzoic acid Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO5S/c1-3-4-5-6-7-8-15-29(26,27)23-21-14-11-18(16-20(21)22(24)25)17-9-12-19(28-2)13-10-17/h9-14,16,23H,3-8,15H2,1-2H3,(H,24,25)