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

Systemtic Name: 5-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-2-fluoranyl-benzenecarbonitrile Openeye Name: 5-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-2-fluoro-benzonitrile CAS Name: 5-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-2-fluorobenzonitrile IUPAC Name: 5-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indol-7-yl)-2-fluorobenzonitrile Traditional Name: 5-(2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepin[1,7-a]indol-7-yl)-2-fluoro-benzonitrile Formula: C19H18FN3 MolecularWeight: 307.364723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18FN3/c20-18-5-4-13(10-15(18)12-21)17-3-1-2-14-11-16-6-7-22-8-9-23(16)19(14)17/h1-5,10,16,22H,6-9,11H2