[3-(cyanomethyl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-2-yl]methyl furan-2-carboxylate

Systemtic Name: [3-(cyanomethyl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-2-yl]methyl furan-2-carboxylate Openeye Name: [3-(cyanomethyl)-6,7-dimethoxy-4-oxo-quinazolin-2-yl]methyl furan-2-carboxylate CAS Name: 2-furancarboxylic acid [3-(cyanomethyl)-6,7-dimethoxy-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-6,7-dimethoxy-4-oxoquinazolin-2-yl]methyl furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [3-(cyanomethyl)-4-keto-6,7-dimethoxy-quinazolin-2-yl]methyl ester Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)COC(=O)C3=CC=CO3)CC#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)COC(=O)C3=CC=CO3)CC#N)OC

InChI

InChI=1S/C18H15N3O6/c1-24-14-8-11-12(9-15(14)25-2)20-16(21(6-5-19)17(11)22)10-27-18(23)13-4-3-7-26-13/h3-4,7-9H,6,10H2,1-2H3