(2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: (2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-piperazin-4-ium-1-yl-propan-1-one Openeye Name: (2R)-1-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-piperazin-4-ium-1-yl-propan-1-one CAS Name: (2R)-1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-2-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-piperazin-4-ium-1-ylpropan-1-one Traditional Name: (2R)-1-[(3S,5S)-3,5-dimethylpiperidino]-2-piperazin-4-ium-1-yl-propan-1-one Formula: C14H28N3O+ MolecularWeight: 254.39162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C(C)N2CC[NH2+]CC2)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)[C@@H](C)N2CC[NH2+]CC2)C

InChI

InChI=1S/C14H27N3O/c1-11-8-12(2)10-17(9-11)14(18)13(3)16-6-4-15-5-7-16/h11-13,15H,4-10H2,1-3H3/p+1/t11-,12-,13+/m0/s1