2-(4-bromanyl-2,6-dimethyl-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-pyridine-3-carboxylic acid Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-4-[ethyl(propyl)amino]-6-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-4-[ethyl(propyl)amino]-6-methylpyridine-3-carboxylic acid Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-4-[ethyl(propyl)amino]-6-methyl-nicotinic acid Formula: C20H25BrN2O3 MolecularWeight: 421.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC)C1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2C)Br)C)C

Isomeric SMILES

CCCN(CC)C1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2C)Br)C)C

InChI

InChI=1S/C20H25BrN2O3/c1-6-8-23(7-2)16-11-14(5)22-19(17(16)20(24)25)26-18-12(3)9-15(21)10-13(18)4/h9-11H,6-8H2,1-5H3,(H,24,25)