1-(1,4-diazepan-4-ium-1-yl)-2-ethyl-butan-1-one

Systemtic Name: 1-(1,4-diazepan-4-ium-1-yl)-2-ethyl-butan-1-one Openeye Name: 1-(1,4-diazepan-4-ium-1-yl)-2-ethyl-butan-1-one CAS Name: 1-(1,4-diazepan-4-ium-1-yl)-2-ethyl-1-butanone IUPAC Name: 1-(1,4-diazepan-4-ium-1-yl)-2-ethylbutan-1-one Traditional Name: 1-(1,4-diazepan-4-ium-1-yl)-2-ethyl-butan-1-one Formula: C11H23N2O+ MolecularWeight: 199.31312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCC[NH2+]CC1

Isomeric SMILES

CCC(CC)C(=O)N1CCC[NH2+]CC1

InChI

InChI=1S/C11H22N2O/c1-3-10(4-2)11(14)13-8-5-6-12-7-9-13/h10,12H,3-9H2,1-2H3/p+1