4-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-3-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-3-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-3-(trifluoromethyl)benzonitrile CAS Name: 4-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-3-(trifluoromethyl)benzonitrile IUPAC Name: 4-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-3-(trifluoromethyl)benzonitrile Traditional Name: 4-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepin[1,7-a]indol-7-yl)-3-(trifluoromethyl)benzonitrile Formula: C20H18F3N3 MolecularWeight: 357.37223

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN2C1CC3=CC=CC(=C32)C4=C(C=C(C=C4)C#N)C(F)(F)F

Isomeric SMILES

C1CNCCN2C1CC3=CC=CC(=C32)C4=C(C=C(C=C4)C#N)C(F)(F)F

InChI

InChI=1S/C20H18F3N3/c21-20(22,23)18-10-13(12-24)4-5-16(18)17-3-1-2-14-11-15-6-7-25-8-9-26(15)19(14)17/h1-5,10,15,25H,6-9,11H2