3-methyl-1-(4-piperazin-4-ium-1-ylpiperidin-1-yl)butan-1-one

Systemtic Name: 3-methyl-1-(4-piperazin-4-ium-1-ylpiperidin-1-yl)butan-1-one Openeye Name: 3-methyl-1-(4-piperazin-4-ium-1-yl-1-piperidyl)butan-1-one CAS Name: 3-methyl-1-[4-(1-piperazin-4-iumyl)-1-piperidinyl]-1-butanone IUPAC Name: 3-methyl-1-(4-piperazin-4-ium-1-ylpiperidin-1-yl)butan-1-one Traditional Name: 3-methyl-1-(4-piperazin-4-ium-1-ylpiperidino)butan-1-one Formula: C14H28N3O+ MolecularWeight: 254.39162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC(CC1)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)CC(=O)N1CCC(CC1)N2CC[NH2+]CC2

InChI

InChI=1S/C14H27N3O/c1-12(2)11-14(18)17-7-3-13(4-8-17)16-9-5-15-6-10-16/h12-13,15H,3-11H2,1-2H3/p+1