6-[3-(azepan-1-yl)propyl]-9-bromanyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile

Systemtic Name: 6-[3-(azepan-1-yl)propyl]-9-bromanyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile Openeye Name: 6-[3-(azepan-1-yl)propyl]-9-bromo-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile CAS Name: 6-[3-(1-azepanyl)propyl]-9-bromo-6,11-dihydrobenzo[c][1]benzoxepin-11-carbonitrile IUPAC Name: 6-[3-(azepan-1-yl)propyl]-9-bromo-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile Traditional Name: 6-[3-(azepan-1-yl)propyl]-9-bromo-6,11-dihydrobenzo[c][1]benzoxepin-11-carbonitrile Formula: C24H27BrN2O MolecularWeight: 439.38798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCC2C3=C(C=C(C=C3)Br)C(C4=CC=CC=C4O2)C#N

Isomeric SMILES

C1CCCN(CC1)CCCC2C3=C(C=C(C=C3)Br)C(C4=CC=CC=C4O2)C#N

InChI

InChI=1S/C24H27BrN2O/c25-18-11-12-20-21(16-18)22(17-26)19-8-3-4-9-23(19)28-24(20)10-7-15-27-13-5-1-2-6-14-27/h3-4,8-9,11-12,16,22,24H,1-2,5-7,10,13-15H2