4-[[[4-(methylsulfonylmethyl)phenyl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[4-(methylsulfonylmethyl)phenyl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[4-(methylsulfonylmethyl)benzoyl]amino]methyl]benzoic acid CAS Name: 4-[[[[4-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[4-(methylsulfonylmethyl)benzoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[4-(mesylmethyl)benzoyl]amino]methyl]benzoic acid Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5S/c1-24(22,23)11-13-4-6-14(7-5-13)16(19)18-10-12-2-8-15(9-3-12)17(20)21/h2-9H,10-11H2,1H3,(H,18,19)(H,20,21)