2-(4-bromanyl-2,6-dimethyl-phenoxy)-4-(1-methoxybutan-2-ylamino)-6-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-4-(1-methoxybutan-2-ylamino)-6-methyl-pyridine-3-carboxylic acid Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-4-[1-(methoxymethyl)propylamino]-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-4-(1-methoxybutan-2-ylamino)-6-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-4-(1-methoxybutan-2-ylamino)-6-methylpyridine-3-carboxylic acid Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-4-[1-(methoxymethyl)propylamino]-6-methyl-nicotinic acid Formula: C20H25BrN2O4 MolecularWeight: 437.3275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC)NC1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2C)Br)C)C

Isomeric SMILES

CCC(COC)NC1=CC(=NC(=C1C(=O)O)OC2=C(C=C(C=C2C)Br)C)C

InChI

InChI=1S/C20H25BrN2O4/c1-6-15(10-26-5)23-16-9-13(4)22-19(17(16)20(24)25)27-18-11(2)7-14(21)8-12(18)3/h7-9,15H,6,10H2,1-5H3,(H,22,23)(H,24,25)