2-[(4-chloranylphenoxy)methyl]-3-(2-methylpropyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-3-(2-methylpropyl)-1H-benzimidazol-3-ium Openeye Name: 2-[(4-chlorophenoxy)methyl]-3-isobutyl-1H-benzimidazol-3-ium CAS Name: 2-[(4-chlorophenoxy)methyl]-3-(2-methylpropyl)-1H-benzimidazol-3-ium IUPAC Name: 2-[(4-chlorophenoxy)methyl]-3-(2-methylpropyl)-1H-benzimidazol-3-ium Traditional Name: 2-[(4-chlorophenoxy)methyl]-3-isobutyl-1H-benzimidazol-3-ium Formula: C18H20ClN2O+ MolecularWeight: 315.8172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O/c1-13(2)11-21-17-6-4-3-5-16(17)20-18(21)12-22-15-9-7-14(19)8-10-15/h3-10,13H,11-12H2,1-2H3/p+1