3-(3-methylbutyl)-4-oxidanylidene-quinazoline-7-carboxylic acid

Systemtic Name: 3-(3-methylbutyl)-4-oxidanylidene-quinazoline-7-carboxylic acid Openeye Name: 3-isopentyl-4-oxo-quinazoline-7-carboxylic acid CAS Name: 3-(3-methylbutyl)-4-oxo-7-quinazolinecarboxylic acid IUPAC Name: 3-(3-methylbutyl)-4-oxoquinazoline-7-carboxylic acid Traditional Name: 3-isoamyl-4-keto-quinazoline-7-carboxylic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=NC2=C(C1=O)C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)CCN1C=NC2=C(C1=O)C=CC(=C2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-9(2)5-6-16-8-15-12-7-10(14(18)19)3-4-11(12)13(16)17/h3-4,7-9H,5-6H2,1-2H3,(H,18,19)