2-[(5-tert-butyl-2,3-dimethyl-phenyl)sulfonyl-methyl-amino]benzoic acid

Systemtic Name: 2-[(5-tert-butyl-2,3-dimethyl-phenyl)sulfonyl-methyl-amino]benzoic acid Openeye Name: 2-[(5-tert-butyl-2,3-dimethyl-phenyl)sulfonyl-methyl-amino]benzoic acid CAS Name: 2-[(5-tert-butyl-2,3-dimethylphenyl)sulfonyl-methylamino]benzoic acid IUPAC Name: 2-[(5-tert-butyl-2,3-dimethylphenyl)sulfonyl-methylamino]benzoic acid Traditional Name: 2-[(5-tert-butyl-2,3-dimethyl-phenyl)sulfonyl-methyl-amino]benzoic acid Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)C)S(=O)(=O)N(C)C2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)C)S(=O)(=O)N(C)C2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C20H25NO4S/c1-13-11-15(20(3,4)5)12-18(14(13)2)26(24,25)21(6)17-10-8-7-9-16(17)19(22)23/h7-12H,1-6H3,(H,22,23)