2-[(4,5-dimethyl-2-propoxy-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 2-[(4,5-dimethyl-2-propoxy-phenyl)sulfonylamino]benzoic acid Openeye Name: 2-[(4,5-dimethyl-2-propoxy-phenyl)sulfonylamino]benzoic acid CAS Name: 2-[(4,5-dimethyl-2-propoxyphenyl)sulfonylamino]benzoic acid IUPAC Name: 2-[(4,5-dimethyl-2-propoxyphenyl)sulfonylamino]benzoic acid Traditional Name: 2-[(4,5-dimethyl-2-propoxy-phenyl)sulfonylamino]benzoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)C)C)S(=O)(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)C)C)S(=O)(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H21NO5S/c1-4-9-24-16-10-12(2)13(3)11-17(16)25(22,23)19-15-8-6-5-7-14(15)18(20)21/h5-8,10-11,19H,4,9H2,1-3H3,(H,20,21)