1-[1,3-bis[(3-methylimidazol-3-ium-1-yl)methoxy]propan-2-yloxymethyl]-3-methyl-imidazol-3-ium

Systemtic Name: 1-[1,3-bis[(3-methylimidazol-3-ium-1-yl)methoxy]propan-2-yloxymethyl]-3-methyl-imidazol-3-ium Openeye Name: 1-[2,3-bis[(3-methylimidazol-3-ium-1-yl)methoxy]propoxymethyl]-3-methyl-imidazol-3-ium CAS Name: 1-[1,3-bis[(3-methyl-1-imidazol-3-iumyl)methoxy]propan-2-yloxymethyl]-3-methylimidazol-3-ium IUPAC Name: 1-[1,3-bis[(3-methylimidazol-3-ium-1-yl)methoxy]propan-2-yloxymethyl]-3-methylimidazol-3-ium Traditional Name: 1-[2,3-bis[(3-methylimidazol-3-ium-1-yl)methoxy]propoxymethyl]-3-methyl-imidazol-3-ium Formula: C18H29N6O3+3 MolecularWeight: 377.46126

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)COCC(COCN2C=C[N+](=C2)C)OCN3C=C[N+](=C3)C

Isomeric SMILES

C[N+]1=CN(C=C1)COCC(COCN2C=C[N+](=C2)C)OCN3C=C[N+](=C3)C

InChI

InChI=1S/C18H29N6O3/c1-19-4-7-22(12-19)15-25-10-18(27-17-24-9-6-21(3)14-24)11-26-16-23-8-5-20(2)13-23/h4-9,12-14,18H,10-11,15-17H2,1-3H3/q+3