4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoic acid Openeye Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoic acid CAS Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoic acid IUPAC Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoic acid Traditional Name: 4-[(mesitylsulfonylamino)methyl]benzoic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C17H19NO4S/c1-11-8-12(2)16(13(3)9-11)23(21,22)18-10-14-4-6-15(7-5-14)17(19)20/h4-9,18H,10H2,1-3H3,(H,19,20)