[(2S)-1-(4-azaniumylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-cyclohexyl-methyl-azanium

Systemtic Name: [(2S)-1-(4-azaniumylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-cyclohexyl-methyl-azanium Openeye Name: [(1S)-2-(4-azaniumyl-1-piperidyl)-1-methyl-2-oxo-ethyl]-cyclohexyl-methyl-ammonium CAS Name: [(2S)-1-(4-ammonio-1-piperidinyl)-1-oxopropan-2-yl]-cyclohexyl-methylammonium IUPAC Name: [(2S)-1-(4-azaniumylpiperidin-1-yl)-1-oxopropan-2-yl]-cyclohexyl-methylazanium Traditional Name: [(1S)-2-(4-ammoniopiperidino)-2-keto-1-methyl-ethyl]-cyclohexyl-methyl-ammonium Formula: C15H31N3O+2 MolecularWeight: 269.42614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)[NH3+])[NH+](C)C2CCCCC2

Isomeric SMILES

C[C@@H](C(=O)N1CCC(CC1)[NH3+])[NH+](C)C2CCCCC2

InChI

InChI=1S/C15H29N3O/c1-12(17(2)14-6-4-3-5-7-14)15(19)18-10-8-13(16)9-11-18/h12-14H,3-11,16H2,1-2H3/p+2/t12-/m0/s1