3-[2-[4-(phenylmethyl)phenoxy]ethyl]-1H-imidazo[4,5-c]pyridin-3-ium

Systemtic Name: 3-[2-[4-(phenylmethyl)phenoxy]ethyl]-1H-imidazo[4,5-c]pyridin-3-ium Openeye Name: 3-[2-(4-benzylphenoxy)ethyl]-1H-imidazo[4,5-c]pyridin-3-ium CAS Name: 3-[2-[4-(phenylmethyl)phenoxy]ethyl]-1H-imidazo[4,5-c]pyridin-3-ium IUPAC Name: 3-[2-(4-benzylphenoxy)ethyl]-1H-imidazo[4,5-c]pyridin-3-ium Traditional Name: 3-[2-(4-benzylphenoxy)ethyl]-1H-imidazo[4,5-c]pyridin-3-ium Formula: C21H20N3O+ MolecularWeight: 330.403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(C=C2)OCC[N+]3=CNC4=C3C=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)OCC[N+]3=CNC4=C3C=NC=C4

InChI

InChI=1S/C21H19N3O/c1-2-4-17(5-3-1)14-18-6-8-19(9-7-18)25-13-12-24-16-23-20-10-11-22-15-21(20)24/h1-11,15-16H,12-14H2/p+1