2-butyl-4-oxidanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 2-butyl-4-oxidanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 2-butyl-4-oxo-1H-quinazoline-7-carboxylic acid CAS Name: 2-butyl-4-oxo-1H-quinazoline-7-carboxylic acid IUPAC Name: 2-butyl-4-oxo-1H-quinazoline-7-carboxylic acid Traditional Name: 2-butyl-4-keto-1H-quinazoline-7-carboxylic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)O

Isomeric SMILES

CCCCC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)O

InChI

InChI=1S/C13H14N2O3/c1-2-3-4-11-14-10-7-8(13(17)18)5-6-9(10)12(16)15-11/h5-7H,2-4H2,1H3,(H,17,18)(H,14,15,16)