2-(6-chloranylpyridin-2-yl)-4-(4-methoxycarbonylphenyl)-6-methyl-5-(2-methylpropoxycarbonyl)pyridine-3-carboxylic acid

Systemtic Name: 2-(6-chloranylpyridin-2-yl)-4-(4-methoxycarbonylphenyl)-6-methyl-5-(2-methylpropoxycarbonyl)pyridine-3-carboxylic acid Openeye Name: 2-(6-chloro-2-pyridyl)-5-isobutoxycarbonyl-4-(4-methoxycarbonylphenyl)-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-(6-chloro-2-pyridinyl)-4-(4-methoxycarbonylphenyl)-6-methyl-5-[2-methylpropoxy(oxo)methyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(6-chloropyridin-2-yl)-4-(4-methoxycarbonylphenyl)-6-methyl-5-(2-methylpropoxycarbonyl)pyridine-3-carboxylic acid Traditional Name: 4-(4-carbomethoxyphenyl)-2-(6-chloro-2-pyridyl)-5-isobutoxycarbonyl-6-methyl-nicotinic acid Formula: C25H23ClN2O6 MolecularWeight: 482.91292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C2=NC(=CC=C2)Cl)C(=O)O)C3=CC=C(C=C3)C(=O)OC)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(=C(C(=N1)C2=NC(=CC=C2)Cl)C(=O)O)C3=CC=C(C=C3)C(=O)OC)C(=O)OCC(C)C

InChI

InChI=1S/C25H23ClN2O6/c1-13(2)12-34-25(32)19-14(3)27-22(17-6-5-7-18(26)28-17)21(23(29)30)20(19)15-8-10-16(11-9-15)24(31)33-4/h5-11,13H,12H2,1-4H3,(H,29,30)