2-(2-butoxy-5-methyl-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-(2-butoxy-5-methyl-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-(2-butoxy-5-methyl-phenyl)-4-oxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-(2-butoxy-5-methylphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-(2-butoxy-5-methylphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid Traditional Name: 2-(2-butoxy-5-methyl-phenyl)-4-keto-1H-quinazoline-6-carboxylic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C20H20N2O4/c1-3-4-9-26-17-8-5-12(2)10-15(17)18-21-16-7-6-13(20(24)25)11-14(16)19(23)22-18/h5-8,10-11H,3-4,9H2,1-2H3,(H,24,25)(H,21,22,23)