diphenylmethanimine; ethyl 2-[bis(fluoranyl)methyl]-4-cyano-butanoate

Systemtic Name: diphenylmethanimine; ethyl 2-[bis(fluoranyl)methyl]-4-cyano-butanoate Openeye Name: diphenylmethanimine; ethyl 4-cyano-2-(difluoromethyl)butanoate CAS Name: 4-cyano-2-(difluoromethyl)butanoic acid ethyl ester; diphenylmethanimine IUPAC Name: diphenylmethanimine; ethyl 4-cyano-2-(difluoromethyl)butanoate Traditional Name: benzhydrylideneamine; 4-cyano-2-(difluoromethyl)butyric acid ethyl ester Formula: C21H22F2N2O2 MolecularWeight: 372.408386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC#N)C(F)F.C1=CC=C(C=C1)C(=N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CCC#N)C(F)F.C1=CC=C(C=C1)C(=N)C2=CC=CC=C2

InChI

InChI=1S/C13H11N.C8H11F2NO2/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-13-8(12)6(7(9)10)4-3-5-11/h1-10,14H;6-7H,2-4H2,1H3