1-tert-butyl-4-oxidanylidene-6-phenyl-pyridine-3-carboxylic acid

Systemtic Name: 1-tert-butyl-4-oxidanylidene-6-phenyl-pyridine-3-carboxylic acid Openeye Name: 1-tert-butyl-4-oxo-6-phenyl-pyridine-3-carboxylic acid CAS Name: 1-tert-butyl-4-oxo-6-phenyl-3-pyridinecarboxylic acid IUPAC Name: 1-tert-butyl-4-oxo-6-phenylpyridine-3-carboxylic acid Traditional Name: 1-tert-butyl-4-keto-6-phenyl-nicotinic acid Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C=C1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C=C1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO3/c1-16(2,3)17-10-12(15(19)20)14(18)9-13(17)11-7-5-4-6-8-11/h4-10H,1-3H3,(H,19,20)