4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxypyridine-2-carboxylic acid

Systemtic Name: 4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxypyridine-2-carboxylic acid Openeye Name: 4-[2-(4-bromo-3-methyl-anilino)-6-methoxy-1-methyl-benzimidazol-5-yl]oxypyridine-2-carboxylic acid CAS Name: 4-[[2-(4-bromo-3-methylanilino)-6-methoxy-1-methyl-5-benzimidazolyl]oxy]-2-pyridinecarboxylic acid IUPAC Name: 4-[2-(4-bromo-3-methylanilino)-6-methoxy-1-methylbenzimidazol-5-yl]oxypyridine-2-carboxylic acid Traditional Name: 4-[2-(4-bromo-3-methyl-anilino)-6-methoxy-1-methyl-benzimidazol-5-yl]oxypicolinic acid Formula: C22H19BrN4O4 MolecularWeight: 483.31466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC3=CC(=C(C=C3N2C)OC)OC4=CC(=NC=C4)C(=O)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC3=CC(=C(C=C3N2C)OC)OC4=CC(=NC=C4)C(=O)O)Br

InChI

InChI=1S/C22H19BrN4O4/c1-12-8-13(4-5-15(12)23)25-22-26-16-10-20(19(30-3)11-18(16)27(22)2)31-14-6-7-24-17(9-14)21(28)29/h4-11H,1-3H3,(H,25,26)(H,28,29)