4-[1,4-diazepan-1-yl-(3-methylpyridin-2-yl)methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[1,4-diazepan-1-yl-(3-methylpyridin-2-yl)methyl]-N,N-dimethyl-aniline Openeye Name: 4-[1,4-diazepan-1-yl-(3-methyl-2-pyridyl)methyl]-N,N-dimethyl-aniline CAS Name: 4-[1,4-diazepan-1-yl-(3-methyl-2-pyridinyl)methyl]-N,N-dimethylaniline IUPAC Name: 4-[1,4-diazepan-1-yl-(3-methylpyridin-2-yl)methyl]-N,N-dimethylaniline Traditional Name: [4-[1,4-diazepan-1-yl-(3-methyl-2-pyridyl)methyl]phenyl]-dimethyl-amine Formula: C20H28N4 MolecularWeight: 324.46312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCNCC3

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCNCC3

InChI

InChI=1S/C20H28N4/c1-16-6-4-12-22-19(16)20(24-14-5-11-21-13-15-24)17-7-9-18(10-8-17)23(2)3/h4,6-10,12,20-21H,5,11,13-15H2,1-3H3