2-butyl-1-[(2-chlorophenyl)methyl]benzimidazol-1-ium-1-carboxylic acid

Systemtic Name: 2-butyl-1-[(2-chlorophenyl)methyl]benzimidazol-1-ium-1-carboxylic acid Openeye Name: 2-butyl-1-[(2-chlorophenyl)methyl]benzimidazol-1-ium-1-carboxylic acid CAS Name: 2-butyl-1-[(2-chlorophenyl)methyl]-1-benzimidazol-1-iumcarboxylic acid IUPAC Name: 2-butyl-1-[(2-chlorophenyl)methyl]benzimidazol-1-ium-1-carboxylic acid Traditional Name: 2-butyl-1-(2-chlorobenzyl)benzimidazol-1-ium-1-carboxylic acid Formula: C19H20ClN2O2+ MolecularWeight: 343.8273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2[N+]1(CC3=CC=CC=C3Cl)C(=O)O

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2[N+]1(CC3=CC=CC=C3Cl)C(=O)O

InChI

InChI=1S/C19H19ClN2O2/c1-2-3-12-18-21-16-10-6-7-11-17(16)22(18,19(23)24)13-14-8-4-5-9-15(14)20/h4-11H,2-3,12-13H2,1H3/p+1