2-[5-(2-ethoxyethoxy)-2-methoxy-phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-[5-(2-ethoxyethoxy)-2-methoxy-phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-[5-(2-ethoxyethoxy)-2-methoxy-phenyl]-4-oxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-[5-(2-ethoxyethoxy)-2-methoxyphenyl]-4-oxo-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-[5-(2-ethoxyethoxy)-2-methoxyphenyl]-4-oxo-1H-quinazoline-6-carboxylic acid Traditional Name: 2-[5-(2-ethoxyethoxy)-2-methoxy-phenyl]-4-keto-1H-quinazoline-6-carboxylic acid Formula: C20H20N2O6 MolecularWeight: 384.3826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC(=C(C=C1)OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCOCCOC1=CC(=C(C=C1)OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C20H20N2O6/c1-3-27-8-9-28-13-5-7-17(26-2)15(11-13)18-21-16-6-4-12(20(24)25)10-14(16)19(23)22-18/h4-7,10-11H,3,8-9H2,1-2H3,(H,24,25)(H,21,22,23)