4-(1,3-benzodioxol-5-yloxy)-2-[4-(1H-imidazol-3-ium-3-yl)phenoxy]pyrimidine

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-2-[4-(1H-imidazol-3-ium-3-yl)phenoxy]pyrimidine Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-2-[4-(1H-imidazol-3-ium-3-yl)phenoxy]pyrimidine CAS Name: 4-(1,3-benzodioxol-5-yloxy)-2-[4-(1H-imidazol-3-ium-3-yl)phenoxy]pyrimidine IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-2-[4-(1H-imidazol-3-ium-3-yl)phenoxy]pyrimidine Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-2-[4-(1H-imidazol-3-ium-3-yl)phenoxy]pyrimidine Formula: C20H15N4O4+ MolecularWeight: 375.3575

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC3=NC(=NC=C3)OC4=CC=C(C=C4)[N+]5=CNC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC3=NC(=NC=C3)OC4=CC=C(C=C4)[N+]5=CNC=C5

InChI

InChI=1S/C20H14N4O4/c1-3-15(4-2-14(1)24-10-9-21-12-24)28-20-22-8-7-19(23-20)27-16-5-6-17-18(11-16)26-13-25-17/h1-12H,13H2/p+1