1-(4-bromanylisoquinolin-1-yl)-2,7-dimethyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-(4-bromanylisoquinolin-1-yl)-2,7-dimethyl-benzimidazole-5-carboxylic acid Openeye Name: 1-(4-bromo-1-isoquinolyl)-2,7-dimethyl-benzimidazole-5-carboxylic acid CAS Name: 1-(4-bromo-1-isoquinolinyl)-2,7-dimethyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-(4-bromoisoquinolin-1-yl)-2,7-dimethylbenzimidazole-5-carboxylic acid Traditional Name: 1-(4-bromo-1-isoquinolyl)-2,7-dimethyl-benzimidazole-5-carboxylic acid Formula: C19H14BrN3O2 MolecularWeight: 396.23736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=O)O)N=C(N2C3=NC=C(C4=CC=CC=C43)Br)C

Isomeric SMILES

CC1=C2C(=CC(=C1)C(=O)O)N=C(N2C3=NC=C(C4=CC=CC=C43)Br)C

InChI

InChI=1S/C19H14BrN3O2/c1-10-7-12(19(24)25)8-16-17(10)23(11(2)22-16)18-14-6-4-3-5-13(14)15(20)9-21-18/h3-9H,1-2H3,(H,24,25)