3-(2-methylprop-2-enyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium

Systemtic Name: 3-(2-methylprop-2-enyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium Openeye Name: 3-(2-methylallyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium CAS Name: 3-(2-methylprop-2-enyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium IUPAC Name: 3-(2-methylprop-2-enyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium Traditional Name: 3-(2-methylallyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium Formula: C18H19N2O+ MolecularWeight: 279.35626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[N+]1=C(NC2=CC=CC=C21)COC3=CC=CC=C3

Isomeric SMILES

CC(=C)C[N+]1=C(NC2=CC=CC=C21)COC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O/c1-14(2)12-20-17-11-7-6-10-16(17)19-18(20)13-21-15-8-4-3-5-9-15/h3-11H,1,12-13H2,2H3/p+1