4-(4-bromanylpyridin-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(4-bromanylpyridin-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(4-bromo-2-pyridyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(4-bromo-2-pyridinyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(4-bromopyridin-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(4-bromo-2-pyridyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C14H13BrN2O4 MolecularWeight: 353.16802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=NC=CC(=C2)Br)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=NC=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C14H13BrN2O4/c1-6-10(13(18)19)12(9-5-8(15)3-4-16-9)11(14(20)21)7(2)17-6/h3-5,12,17H,1-2H3,(H,18,19)(H,20,21)