2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium

Systemtic Name: 2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium Openeye Name: 3-allyl-2-[(4-methylphenoxy)methyl]-1H-benzimidazol-3-ium CAS Name: 2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium IUPAC Name: 2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium Traditional Name: 3-allyl-2-[(4-methylphenoxy)methyl]-1H-benzimidazol-3-ium Formula: C18H19N2O+ MolecularWeight: 279.35626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=[N+](C3=CC=CC=C3N2)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=[N+](C3=CC=CC=C3N2)CC=C

InChI

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