2-(4-methyl-1,4-diazepan-1-yl)-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-(4-methyl-1,4-diazepan-1-yl)-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-(4-methyl-1,4-diazepan-1-yl)-5-(trifluoromethyl)benzonitrile CAS Name: 2-(4-methyl-1,4-diazepan-1-yl)-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)-5-(trifluoromethyl)benzonitrile Traditional Name: 2-(4-methyl-1,4-diazepan-1-yl)-5-(trifluoromethyl)benzonitrile Formula: C14H16F3N3 MolecularWeight: 283.29215

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CN1CCCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C14H16F3N3/c1-19-5-2-6-20(8-7-19)13-4-3-12(14(15,16)17)9-11(13)10-18/h3-4,9H,2,5-8H2,1H3