1-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-4-phenyl-piperidin-1-ium-4-ol

Systemtic Name: 1-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-4-phenyl-piperidin-1-ium-4-ol Openeye Name: 1-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-4-phenyl-piperidin-1-ium-4-ol CAS Name: 1-[[(2S)-1-methyl-2-piperidin-1-iumyl]methyl]-4-phenyl-4-piperidin-1-iumol IUPAC Name: 1-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-4-phenylpiperidin-1-ium-4-ol Traditional Name: 1-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-4-phenyl-piperidin-1-ium-4-ol Formula: C18H30N2O+2 MolecularWeight: 290.4436

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1C[NH+]2CCC(CC2)(C3=CC=CC=C3)O

Isomeric SMILES

C[NH+]1CCCC[C@H]1C[NH+]2CCC(CC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C18H28N2O/c1-19-12-6-5-9-17(19)15-20-13-10-18(21,11-14-20)16-7-3-2-4-8-16/h2-4,7-8,17,21H,5-6,9-15H2,1H3/p+2/t17-/m0/s1