methyl 2-cyano-4,4,4-tris(fluoranyl)-3-[(4-methoxyphenyl)amino]but-2-enoate

Systemtic Name: methyl 2-cyano-4,4,4-tris(fluoranyl)-3-[(4-methoxyphenyl)amino]but-2-enoate Openeye Name: methyl 2-cyano-4,4,4-trifluoro-3-(4-methoxyanilino)but-2-enoate CAS Name: 2-cyano-4,4,4-trifluoro-3-(4-methoxyanilino)-2-butenoic acid methyl ester IUPAC Name: methyl 2-cyano-4,4,4-trifluoro-3-(4-methoxyanilino)but-2-enoate Traditional Name: 2-cyano-4,4,4-trifluoro-3-(p-anisidino)but-2-enoic acid methyl ester Formula: C13H11F3N2O3 MolecularWeight: 300.23325

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=C(C#N)C(=O)OC)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=C(C#N)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C13H11F3N2O3/c1-20-9-5-3-8(4-6-9)18-11(13(14,15)16)10(7-17)12(19)21-2/h3-6,18H,1-2H3