1-[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one Formula: C13H27N3O MolecularWeight: 241.37298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCN(CC1)CCCCN

Isomeric SMILES

CC(C)C(=O)N1CCCN(CC1)CCCCN

InChI

InChI=1S/C13H27N3O/c1-12(2)13(17)16-9-5-8-15(10-11-16)7-4-3-6-14/h12H,3-11,14H2,1-2H3