N-[2-(azepan-1-yl)ethyl]-2-bromanyl-4,5-dimethoxy-aniline

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-bromanyl-4,5-dimethoxy-aniline Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-bromo-4,5-dimethoxy-aniline CAS Name: N-[2-(1-azepanyl)ethyl]-2-bromo-4,5-dimethoxyaniline IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-bromo-4,5-dimethoxyaniline Traditional Name: 2-(azepan-1-yl)ethyl-(2-bromo-4,5-dimethoxy-phenyl)amine Formula: C16H25BrN2O2 MolecularWeight: 357.2859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NCCN2CCCCCC2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NCCN2CCCCCC2)Br)OC

InChI

InChI=1S/C16H25BrN2O2/c1-20-15-11-13(17)14(12-16(15)21-2)18-7-10-19-8-5-3-4-6-9-19/h11-12,18H,3-10H2,1-2H3