2-(2,2-dimethylpropyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-(2,2-dimethylpropyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-(2,2-dimethylpropyl)-4-oxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-(2,2-dimethylpropyl)-4-oxo-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-(2,2-dimethylpropyl)-4-oxo-1H-quinazoline-6-carboxylic acid Traditional Name: 4-keto-2-neopentyl-1H-quinazoline-6-carboxylic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NC(=O)C2=C(N1)C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)CC1=NC(=O)C2=C(N1)C=CC(=C2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-14(2,3)7-11-15-10-5-4-8(13(18)19)6-9(10)12(17)16-11/h4-6H,7H2,1-3H3,(H,18,19)(H,15,16,17)