2-[2-(2-ethoxyethoxy)-3-methoxy-phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-[2-(2-ethoxyethoxy)-3-methoxy-phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-[2-(2-ethoxyethoxy)-3-methoxy-phenyl]-4-oxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-[2-(2-ethoxyethoxy)-3-methoxyphenyl]-4-oxo-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-[2-(2-ethoxyethoxy)-3-methoxyphenyl]-4-oxo-1H-quinazoline-6-carboxylic acid Traditional Name: 2-[2-(2-ethoxyethoxy)-3-methoxy-phenyl]-4-keto-1H-quinazoline-6-carboxylic acid Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=C(C=CC=C1OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCOCCOC1=C(C=CC=C1OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

InChI

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