3-[[4-cyano-3-(trifluoromethyl)phenyl]amino]-2-methoxy-2-methyl-propanoic acid

Systemtic Name: 3-[[4-cyano-3-(trifluoromethyl)phenyl]amino]-2-methoxy-2-methyl-propanoic acid Openeye Name: 3-[4-cyano-3-(trifluoromethyl)anilino]-2-methoxy-2-methyl-propanoic acid CAS Name: 3-[4-cyano-3-(trifluoromethyl)anilino]-2-methoxy-2-methylpropanoic acid IUPAC Name: 3-[4-cyano-3-(trifluoromethyl)anilino]-2-methoxy-2-methylpropanoic acid Traditional Name: 3-[4-cyano-3-(trifluoromethyl)anilino]-2-methoxy-2-methyl-propionic acid Formula: C13H13F3N2O3 MolecularWeight: 302.24913

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC(=C(C=C1)C#N)C(F)(F)F)(C(=O)O)OC

Isomeric SMILES

CC(CNC1=CC(=C(C=C1)C#N)C(F)(F)F)(C(=O)O)OC

InChI

InChI=1S/C13H13F3N2O3/c1-12(21-2,11(19)20)7-18-9-4-3-8(6-17)10(5-9)13(14,15)16/h3-5,18H,7H2,1-2H3,(H,19,20)