N-[(5-methylfuran-2-yl)methyl]-3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-amine

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-amine Openeye Name: N-[(5-methyl-2-furyl)methyl]-3-(p-tolylmethyl)-1H-benzimidazol-3-ium-2-amine CAS Name: N-[(5-methyl-2-furanyl)methyl]-3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-amine IUPAC Name: N-[(5-methylfuran-2-yl)methyl]-3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-(4-methylbenzyl)-1H-benzimidazol-3-ium-2-yl]-[(5-methyl-2-furyl)methyl]amine Formula: C21H22N3O+ MolecularWeight: 332.41888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)NCC4=CC=C(O4)C

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)NCC4=CC=C(O4)C

InChI

InChI=1S/C21H21N3O/c1-15-7-10-17(11-8-15)14-24-20-6-4-3-5-19(20)23-21(24)22-13-18-12-9-16(2)25-18/h3-12H,13-14H2,1-2H3,(H,22,23)/p+1