2-[[4-(4-cyanophenyl)phenyl]-methylsulfonyl-amino]ethanoic acid

Systemtic Name: 2-[[4-(4-cyanophenyl)phenyl]-methylsulfonyl-amino]ethanoic acid Openeye Name: 2-[4-(4-cyanophenyl)-N-methylsulfonyl-anilino]acetic acid CAS Name: 2-[4-(4-cyanophenyl)-N-methylsulfonylanilino]acetic acid IUPAC Name: 2-[4-(4-cyanophenyl)-N-methylsulfonylanilino]acetic acid Traditional Name: 2-[4-(4-cyanophenyl)-N-mesyl-anilino]acetic acid Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)O)C1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CS(=O)(=O)N(CC(=O)O)C1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H14N2O4S/c1-23(21,22)18(11-16(19)20)15-8-6-14(7-9-15)13-4-2-12(10-17)3-5-13/h2-9H,11H2,1H3,(H,19,20)