methyl 5-cyano-1-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-cyano-6-keto-1-[(4-keto-8-methyl-1H-quinazolin-2-yl)methyl]nicotinic acid methyl ester Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CN3C=C(C=C(C3=O)C#N)C(=O)OC

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CN3C=C(C=C(C3=O)C#N)C(=O)OC

InChI

InChI=1S/C18H14N4O4/c1-10-4-3-5-13-15(10)20-14(21-16(13)23)9-22-8-12(18(25)26-2)6-11(7-19)17(22)24/h3-6,8H,9H2,1-2H3,(H,20,21,23)