[4-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]phenyl] pyridine-4-carboxylate

Systemtic Name: [4-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]phenyl] pyridine-4-carboxylate Openeye Name: [4-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethyl]amino]phenyl] ester IUPAC Name: [4-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[[2-(4-ketoquinazolin-3-yl)acetyl]amino]phenyl] ester Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)NC3=CC=C(C=C3)OC(=O)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)NC3=CC=C(C=C3)OC(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H16N4O4/c27-20(13-26-14-24-19-4-2-1-3-18(19)21(26)28)25-16-5-7-17(8-6-16)30-22(29)15-9-11-23-12-10-15/h1-12,14H,13H2,(H,25,27)