3-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]propanoic acid

Systemtic Name: 3-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]propanoic acid Openeye Name: 3-[(2-fluorophenyl)methyl-(p-tolylsulfonyl)amino]propanoic acid CAS Name: 3-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(2-fluorobenzyl)-tosyl-amino]propionic acid Formula: C17H18FNO4S MolecularWeight: 351.392523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)O)CC2=CC=CC=C2F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)O)CC2=CC=CC=C2F

InChI

InChI=1S/C17H18FNO4S/c1-13-6-8-15(9-7-13)24(22,23)19(11-10-17(20)21)12-14-4-2-3-5-16(14)18/h2-9H,10-12H2,1H3,(H,20,21)