2-[[4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 2-[[4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 2-[[4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine CAS Name: 2-[[4-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 2-[[4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 2-[[4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine Formula: C18H31N3+2 MolecularWeight: 289.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C2CC[NH+](CC2)CC3=CC=CC=N3)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)C2CC[NH+](CC2)CC3=CC=CC=N3)C

InChI

InChI=1S/C18H29N3/c1-15-11-16(2)13-21(12-15)18-6-9-20(10-7-18)14-17-5-3-4-8-19-17/h3-5,8,15-16,18H,6-7,9-14H2,1-2H3/p+2/t15-,16-/m0/s1