[(2R)-1-(4-azaniumylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-butyl-methyl-azanium

Systemtic Name: [(2R)-1-(4-azaniumylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-butyl-methyl-azanium Openeye Name: [(1R)-2-(4-azaniumyl-1-piperidyl)-1-methyl-2-oxo-ethyl]-butyl-methyl-ammonium CAS Name: [(2R)-1-(4-ammonio-1-piperidinyl)-1-oxopropan-2-yl]-butyl-methylammonium IUPAC Name: [(2R)-1-(4-azaniumylpiperidin-1-yl)-1-oxopropan-2-yl]-butyl-methylazanium Traditional Name: [(1R)-2-(4-ammoniopiperidino)-2-keto-1-methyl-ethyl]-butyl-methyl-ammonium Formula: C13H29N3O+2 MolecularWeight: 243.38886

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C)C(=O)N1CCC(CC1)[NH3+]

Isomeric SMILES

CCCC[NH+](C)[C@H](C)C(=O)N1CCC(CC1)[NH3+]

InChI

InChI=1S/C13H27N3O/c1-4-5-8-15(3)11(2)13(17)16-9-6-12(14)7-10-16/h11-12H,4-10,14H2,1-3H3/p+2/t11-/m1/s1