2-(2H-chromen-3-yl)-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-(2H-chromen-3-yl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-(2H-chromen-3-yl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-(2H-1-benzopyran-3-yl)-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-(2H-chromen-3-yl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-(2H-chromen-3-yl)-4-keto-1H-quinazoline-7-carboxylate Formula: C18H11N2O4- MolecularWeight: 319.29094

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CC=C2O1)C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1C(=CC2=CC=CC=C2O1)C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C18H12N2O4/c21-17-13-6-5-11(18(22)23)8-14(13)19-16(20-17)12-7-10-3-1-2-4-15(10)24-9-12/h1-8H,9H2,(H,22,23)(H,19,20,21)/p-1