4-chloranyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one

Systemtic Name: 4-chloranyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one Openeye Name: 4-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one CAS Name: 4-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-1-butanone IUPAC Name: 4-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one Traditional Name: 4-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one Formula: C10H20ClN2O+ MolecularWeight: 219.7316

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CCCCl

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CCCCl

InChI

InChI=1S/C10H19ClN2O/c1-12-6-3-7-13(9-8-12)10(14)4-2-5-11/h2-9H2,1H3/p+1