1-[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-2-ethyl-hexan-1-one

Systemtic Name: 1-[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-2-ethyl-hexan-1-one Openeye Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethyl-hexan-1-one CAS Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethyl-1-hexanone IUPAC Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethylhexan-1-one Traditional Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-2-ethyl-hexan-1-one Formula: C17H35N3O MolecularWeight: 297.4793

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H35N3O/c1-3-5-9-16(4-2)17(21)20-13-8-12-19(14-15-20)11-7-6-10-18/h16H,3-15,18H2,1-2H3