4-(1,3-benzodioxol-5-yl)-3-methyl-N-[(E)-3-phenylprop-2-enyl]-1H-imidazol-3-ium-2-amine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-3-methyl-N-[(E)-3-phenylprop-2-enyl]-1H-imidazol-3-ium-2-amine Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-[(E)-cinnamyl]-3-methyl-1H-imidazol-3-ium-2-amine CAS Name: 4-(1,3-benzodioxol-5-yl)-3-methyl-N-[(E)-3-phenylprop-2-enyl]-1H-imidazol-3-ium-2-amine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-3-methyl-N-[(E)-3-phenylprop-2-enyl]-1H-imidazol-3-ium-2-amine Traditional Name: [4-(1,3-benzodioxol-5-yl)-3-methyl-1H-imidazol-3-ium-2-yl]-[(E)-cinnamyl]amine Formula: C20H20N3O2+ MolecularWeight: 334.3917

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1C2=CC3=C(C=C2)OCO3)NCC=CC4=CC=CC=C4

Isomeric SMILES

C[N+]1=C(NC=C1C2=CC3=C(C=C2)OCO3)NC/C=C/C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O2/c1-23-17(16-9-10-18-19(12-16)25-14-24-18)13-22-20(23)21-11-5-8-15-6-3-2-4-7-15/h2-10,12-13H,11,14H2,1H3,(H,21,22)/p+1/b8-5+