1,4,6-triethyl-2-oxidanylidene-5-pyrimidin-4-yl-pyridine-3-carboxylic acid

Systemtic Name: 1,4,6-triethyl-2-oxidanylidene-5-pyrimidin-4-yl-pyridine-3-carboxylic acid Openeye Name: 1,4,6-triethyl-2-oxo-5-pyrimidin-4-yl-pyridine-3-carboxylic acid CAS Name: 1,4,6-triethyl-2-oxo-5-(4-pyrimidinyl)-3-pyridinecarboxylic acid IUPAC Name: 1,4,6-triethyl-2-oxo-5-pyrimidin-4-ylpyridine-3-carboxylic acid Traditional Name: 1,4,6-triethyl-2-keto-5-(4-pyrimidyl)nicotinic acid Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(C(=C1C2=NC=NC=C2)CC)CC)C(=O)O

Isomeric SMILES

CCC1=C(C(=O)N(C(=C1C2=NC=NC=C2)CC)CC)C(=O)O

InChI

InChI=1S/C16H19N3O3/c1-4-10-13(11-7-8-17-9-18-11)12(5-2)19(6-3)15(20)14(10)16(21)22/h7-9H,4-6H2,1-3H3,(H,21,22)