3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]benzoic acid Openeye Name: 4-[(4-isopropylphenyl)sulfonylamino]-3-methyl-benzoic acid CAS Name: 3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]benzoic acid IUPAC Name: 3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]benzoic acid Traditional Name: 3-methyl-4-(p-cumenylsulfonylamino)benzoic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C17H19NO4S/c1-11(2)13-4-7-15(8-5-13)23(21,22)18-16-9-6-14(17(19)20)10-12(16)3/h4-11,18H,1-3H3,(H,19,20)