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

Systemtic Name: 5-butyl-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid Openeye Name: 5-butyl-2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyridine-3-carboxylic acid CAS Name: 5-butyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-pyridinecarboxylic acid IUPAC Name: 5-butyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid Traditional Name: 5-butyl-2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)nicotinic acid Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C(=C1)C(=O)O)C2=NC(C(=O)N2)(C)C(C)C

Isomeric SMILES

CCCCC1=CN=C(C(=C1)C(=O)O)C2=NC(C(=O)N2)(C)C(C)C

InChI

InChI=1S/C17H23N3O3/c1-5-6-7-11-8-12(15(21)22)13(18-9-11)14-19-16(23)17(4,20-14)10(2)3/h8-10H,5-7H2,1-4H3,(H,21,22)(H,19,20,23)