7-tert-butyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 7-tert-butyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 7-tert-butyl-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 7-tert-butyl-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 7-tert-butyl-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 7-tert-butyl-4-keto-1H-quinoline-3-carboxylic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)O

InChI

InChI=1S/C14H15NO3/c1-14(2,3)8-4-5-9-11(6-8)15-7-10(12(9)16)13(17)18/h4-7H,1-3H3,(H,15,16)(H,17,18)