1-[4-(3-azanylpropyl)-1,4-diazepan-1-yl]pentan-1-one

Systemtic Name: 1-[4-(3-azanylpropyl)-1,4-diazepan-1-yl]pentan-1-one Openeye Name: 1-[4-(3-aminopropyl)-1,4-diazepan-1-yl]pentan-1-one CAS Name: 1-[4-(3-aminopropyl)-1,4-diazepan-1-yl]-1-pentanone IUPAC Name: 1-[4-(3-aminopropyl)-1,4-diazepan-1-yl]pentan-1-one Traditional Name: 1-[4-(3-aminopropyl)-1,4-diazepan-1-yl]pentan-1-one Formula: C13H27N3O MolecularWeight: 241.37298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCCN(CC1)CCCN

Isomeric SMILES

CCCCC(=O)N1CCCN(CC1)CCCN

InChI

InChI=1S/C13H27N3O/c1-2-3-6-13(17)16-10-5-9-15(11-12-16)8-4-7-14/h2-12,14H2,1H3