4-[(4-methyl-5-propan-2-yl-2-propoxy-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-[(4-methyl-5-propan-2-yl-2-propoxy-phenyl)sulfonylamino]benzoic acid Openeye Name: 4-[(5-isopropyl-4-methyl-2-propoxy-phenyl)sulfonylamino]benzoic acid CAS Name: 4-[(4-methyl-5-propan-2-yl-2-propoxyphenyl)sulfonylamino]benzoic acid IUPAC Name: 4-[(4-methyl-5-propan-2-yl-2-propoxyphenyl)sulfonylamino]benzoic acid Traditional Name: 4-[(5-isopropyl-4-methyl-2-propoxy-phenyl)sulfonylamino]benzoic acid Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)C)C(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)C)C(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H25NO5S/c1-5-10-26-18-11-14(4)17(13(2)3)12-19(18)27(24,25)21-16-8-6-15(7-9-16)20(22)23/h6-9,11-13,21H,5,10H2,1-4H3,(H,22,23)