9-(2-chloranyl-6-fluoranyl-phenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole

Systemtic Name: 9-(2-chloranyl-6-fluoranyl-phenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole Openeye Name: 9-(2-chloro-6-fluoro-phenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole CAS Name: 9-(2-chloro-6-fluorophenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole IUPAC Name: 9-(2-chloro-6-fluorophenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole Traditional Name: 9-(2-chloro-6-fluoro-phenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepin[1,7-a]indole Formula: C18H18ClFN2 MolecularWeight: 316.800323

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN2C1CC3=C2C=CC(=C3)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CNCCN2C1CC3=C2C=CC(=C3)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C18H18ClFN2/c19-15-2-1-3-16(20)18(15)12-4-5-17-13(10-12)11-14-6-7-21-8-9-22(14)17/h1-5,10,14,21H,6-9,11H2