4-(azepan-1-yl)-N'-oxidanyl-2-(trifluoromethyl)benzenecarboximidamide

Systemtic Name: 4-(azepan-1-yl)-N'-oxidanyl-2-(trifluoromethyl)benzenecarboximidamide Openeye Name: 4-(azepan-1-yl)-N'-hydroxy-2-(trifluoromethyl)benzamidine CAS Name: 4-(1-azepanyl)-N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide IUPAC Name: 4-(azepan-1-yl)-N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide Traditional Name: 4-(azepan-1-yl)-N'-hydroxy-2-(trifluoromethyl)benzamidine Formula: C14H18F3N3O MolecularWeight: 301.30743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=C(C=C2)C(=NO)N)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C2=CC(=C(C=C2)/C(=N/O)/N)C(F)(F)F

InChI

InChI=1S/C14H18F3N3O/c15-14(16,17)12-9-10(5-6-11(12)13(18)19-21)20-7-3-1-2-4-8-20/h5-6,9,21H,1-4,7-8H2,(H2,18,19)