N'-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-cyano-4-methoxy-benzenecarboximidamide

Systemtic Name: N'-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-cyano-4-methoxy-benzenecarboximidamide Openeye Name: N'-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-cyano-4-methoxy-benzamidine CAS Name: N'-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-cyano-4-methoxybenzenecarboximidamide IUPAC Name: N'-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-cyano-4-methoxybenzenecarboximidamide Traditional Name: N'-[3,5-bis(trifluoromethyl)benzyl]-N-cyano-4-methoxy-benzamidine Formula: C18H13F6N3O MolecularWeight: 401.305739

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=NCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=NCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC#N

InChI

InChI=1S/C18H13F6N3O/c1-28-15-4-2-12(3-5-15)16(27-10-25)26-9-11-6-13(17(19,20)21)8-14(7-11)18(22,23)24/h2-8H,9H2,1H3,(H,26,27)