6-ethyl-5-methanoyl-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid

Systemtic Name: 6-ethyl-5-methanoyl-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid Openeye Name: 6-ethyl-5-formyl-2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyridine-3-carboxylic acid CAS Name: 6-ethyl-5-formyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-pyridinecarboxylic acid IUPAC Name: 6-ethyl-5-formyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid Traditional Name: 6-ethyl-5-formyl-2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)nicotinic acid Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=N1)C2=NC(C(=O)N2)(C)C(C)C)C(=O)O)C=O

Isomeric SMILES

CCC1=C(C=C(C(=N1)C2=NC(C(=O)N2)(C)C(C)C)C(=O)O)C=O

InChI

InChI=1S/C16H19N3O4/c1-5-11-9(7-20)6-10(14(21)22)12(17-11)13-18-15(23)16(4,19-13)8(2)3/h6-8H,5H2,1-4H3,(H,21,22)(H,18,19,23)