2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-ethanone

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-ethanone Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-ethanone CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-1-(1-piperazinyl)ethanone IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-piperazin-1-ylethanone Traditional Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-piperazino-ethanone Formula: C12H24N3O+ MolecularWeight: 226.33846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)N2CCNCC2

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)N2CCNCC2

InChI

InChI=1S/C12H23N3O/c1-11-3-2-6-14(9-11)10-12(16)15-7-4-13-5-8-15/h11,13H,2-10H2,1H3/p+1/t11-/m0/s1