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

Systemtic Name: 2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]propanoic acid Openeye Name: 2-(4-benzyloxy-N-methylsulfonyl-anilino)propanoic acid CAS Name: 2-(N-methylsulfonyl-4-phenylmethoxyanilino)propanoic acid IUPAC Name: 2-(N-methylsulfonyl-4-phenylmethoxyanilino)propanoic acid Traditional Name: 2-(4-benzoxy-N-mesyl-anilino)propionic acid Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=C(C=C1)OCC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)N(C1=CC=C(C=C1)OCC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H19NO5S/c1-13(17(19)20)18(24(2,21)22)15-8-10-16(11-9-15)23-12-14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,19,20)