N-cyano-N'-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-4-(trifluoromethyl)benzenecarboximidamide

Systemtic Name: N-cyano-N'-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-4-(trifluoromethyl)benzenecarboximidamide Openeye Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-4-(trifluoromethyl)benzamidine CAS Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-4-(trifluoromethyl)benzenecarboximidamide IUPAC Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-4-(trifluoromethyl)benzenecarboximidamide Traditional Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-4-(trifluoromethyl)benzamidine Formula: C21H17F3N4O2 MolecularWeight: 414.38049

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N=C(C3=CC=C(C=C3)C(F)(F)F)NC#N)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N=C(C3=CC=C(C=C3)C(F)(F)F)NC#N)O)C

InChI

InChI=1S/C21H17F3N4O2/c1-20(2)18(29)17(15-9-12(10-25)3-8-16(15)30-20)28-19(27-11-26)13-4-6-14(7-5-13)21(22,23)24/h3-9,17-18,29H,1-2H3,(H,27,28)