ethyl 2-(2-methoxy-5-prop-2-enoxy-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylate

Systemtic Name: ethyl 2-(2-methoxy-5-prop-2-enoxy-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylate Openeye Name: ethyl 2-(5-allyloxy-2-methoxy-phenyl)-4-oxo-1H-quinazoline-6-carboxylate CAS Name: 2-(2-methoxy-5-prop-2-enoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-methoxy-5-prop-2-enoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylate Traditional Name: 2-(5-allyloxy-2-methoxy-phenyl)-4-keto-1H-quinazoline-6-carboxylic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC(=NC2=O)C3=C(C=CC(=C3)OCC=C)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC(=NC2=O)C3=C(C=CC(=C3)OCC=C)OC

InChI

InChI=1S/C21H20N2O5/c1-4-10-28-14-7-9-18(26-3)16(12-14)19-22-17-8-6-13(21(25)27-5-2)11-15(17)20(24)23-19/h4,6-9,11-12H,1,5,10H2,2-3H3,(H,22,23,24)