4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoic acid CAS Name: 4-[(5-tert-butyl-2-methylphenyl)sulfonylamino]benzoic acid IUPAC Name: 4-[(5-tert-butyl-2-methylphenyl)sulfonylamino]benzoic acid Traditional Name: 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoic acid Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H21NO4S/c1-12-5-8-14(18(2,3)4)11-16(12)24(22,23)19-15-9-6-13(7-10-15)17(20)21/h5-11,19H,1-4H3,(H,20,21)