2-(furan-2-yl)-3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium

Systemtic Name: 2-(furan-2-yl)-3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium Openeye Name: 2-(2-furyl)-3-[(4-isopropylphenyl)methyl]-1H-benzimidazol-3-ium CAS Name: 2-(2-furanyl)-3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium IUPAC Name: 2-(furan-2-yl)-3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium Traditional Name: 2-(2-furyl)-3-(4-isopropylbenzyl)-1H-benzimidazol-3-ium Formula: C21H21N2O+ MolecularWeight: 317.40424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C21H20N2O/c1-15(2)17-11-9-16(10-12-17)14-23-19-7-4-3-6-18(19)22-21(23)20-8-5-13-24-20/h3-13,15H,14H2,1-2H3/p+1