1-[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-2-ethoxy-ethanone

Systemtic Name: 1-[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-2-ethoxy-ethanone Openeye Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethoxy-ethanone CAS Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethoxyethanone IUPAC Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethoxyethanone Traditional Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethoxy-ethanone Formula: C13H27N3O2 MolecularWeight: 257.37238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)N1CCCN(CC1)CCCCN

Isomeric SMILES

CCOCC(=O)N1CCCN(CC1)CCCCN

InChI

InChI=1S/C13H27N3O2/c1-2-18-12-13(17)16-9-5-8-15(10-11-16)7-4-3-6-14/h2-12,14H2,1H3