1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone

Systemtic Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone Openeye Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone CAS Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone Traditional Name: 1-[(2R,6R)-2,6-dimethylpiperidino]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone Formula: C19H37N3O+2 MolecularWeight: 323.51658

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C[NH+]2CCC(CC2)[NH+]3CCCCC3)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)C[NH+]2CCC(CC2)[NH+]3CCCCC3)C

InChI

InChI=1S/C19H35N3O/c1-16-7-6-8-17(2)22(16)19(23)15-20-13-9-18(10-14-20)21-11-4-3-5-12-21/h16-18H,3-15H2,1-2H3/p+2/t16-,17-/m1/s1