4-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)pentan-1-one

Systemtic Name: 4-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)pentan-1-one Openeye Name: 4-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)pentan-1-one CAS Name: 4-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-1-pentanone IUPAC Name: 4-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)pentan-1-one Traditional Name: 4-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)pentan-1-one Formula: C12H25N2O+ MolecularWeight: 213.3397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H24N2O/c1-11(2)5-6-12(15)14-8-4-7-13(3)9-10-14/h11H,4-10H2,1-3H3/p+1