(1R,2R)-1,2-bis(1-methylpyridin-1-ium-4-yl)ethane-1,2-diol

Systemtic Name: (1R,2R)-1,2-bis(1-methylpyridin-1-ium-4-yl)ethane-1,2-diol Openeye Name: (1R,2R)-1,2-bis(1-methylpyridin-1-ium-4-yl)ethane-1,2-diol CAS Name: (1R,2R)-1,2-bis(1-methyl-4-pyridin-1-iumyl)ethane-1,2-diol IUPAC Name: (1R,2R)-1,2-bis(1-methylpyridin-1-ium-4-yl)ethane-1,2-diol Traditional Name: (1R,2R)-1,2-bis(1-methylpyridin-1-ium-4-yl)ethane-1,2-diol Formula: C14H18N2O2+2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(C(C2=CC=[N+](C=C2)C)O)O

Isomeric SMILES

C[N+]1=CC=C(C=C1)[C@H]([C@@H](C2=CC=[N+](C=C2)C)O)O

InChI

InChI=1S/C14H18N2O2/c1-15-7-3-11(4-8-15)13(17)14(18)12-5-9-16(2)10-6-12/h3-10,13-14,17-18H,1-2H3/q+2/t13-,14-/m1/s1