2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanoic acid

Systemtic Name: 2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanoic acid Openeye Name: 2-(N-methylsulfonyl-4-phenoxy-anilino)propanoic acid CAS Name: 2-(N-methylsulfonyl-4-phenoxyanilino)propanoic acid IUPAC Name: 2-(N-methylsulfonyl-4-phenoxyanilino)propanoic acid Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)propionic acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)N(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C16H17NO5S/c1-12(16(18)19)17(23(2,20)21)13-8-10-15(11-9-13)22-14-6-4-3-5-7-14/h3-12H,1-2H3,(H,18,19)