2-[[4-[[3-(methylsulfonylmethyl)phenyl]carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[[3-(methylsulfonylmethyl)phenyl]carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[[3-(methylsulfonylmethyl)benzoyl]amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[[3-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[[3-(methylsulfonylmethyl)benzoyl]amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[[3-(mesylmethyl)benzoyl]amino]phenyl]sulfonylamino]acetic acid Formula: C17H18N2O7S2 MolecularWeight: 426.46402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O7S2/c1-27(23,24)11-12-3-2-4-13(9-12)17(22)19-14-5-7-15(8-6-14)28(25,26)18-10-16(20)21/h2-9,18H,10-11H2,1H3,(H,19,22)(H,20,21)