[2-methoxy-4-[(Z)-(4-oxidanylidenequinazolin-3-yl)iminomethyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [2-methoxy-4-[(Z)-(4-oxidanylidenequinazolin-3-yl)iminomethyl]phenyl] pyridine-3-carboxylate Openeye Name: [2-methoxy-4-[(Z)-(4-oxoquinazolin-3-yl)iminomethyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-methoxy-4-[(Z)-(4-oxo-3-quinazolinyl)iminomethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(4-oxoquinazolin-3-yl)iminomethyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(Z)-(4-ketoquinazolin-3-yl)iminomethyl]-2-methoxy-phenyl] ester Formula: C22H16N4O4 MolecularWeight: 400.38684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NN2C=NC3=CC=CC=C3C2=O)OC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\N2C=NC3=CC=CC=C3C2=O)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H16N4O4/c1-29-20-11-15(8-9-19(20)30-22(28)16-5-4-10-23-13-16)12-25-26-14-24-18-7-3-2-6-17(18)21(26)27/h2-14H,1H3/b25-12-