3-bromanyl-4-[(2-butylbenzimidazol-1-yl)methyl]benzoic acid

Systemtic Name: 3-bromanyl-4-[(2-butylbenzimidazol-1-yl)methyl]benzoic acid Openeye Name: 3-bromo-4-[(2-butylbenzimidazol-1-yl)methyl]benzoic acid CAS Name: 3-bromo-4-[(2-butyl-1-benzimidazolyl)methyl]benzoic acid IUPAC Name: 3-bromo-4-[(2-butylbenzimidazol-1-yl)methyl]benzoic acid Traditional Name: 3-bromo-4-[(2-butylbenzimidazol-1-yl)methyl]benzoic acid Formula: C19H19BrN2O2 MolecularWeight: 387.27036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=C(C=C(C=C3)C(=O)O)Br

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=C(C=C(C=C3)C(=O)O)Br

InChI

InChI=1S/C19H19BrN2O2/c1-2-3-8-18-21-16-6-4-5-7-17(16)22(18)12-14-10-9-13(19(23)24)11-15(14)20/h4-7,9-11H,2-3,8,12H2,1H3,(H,23,24)