2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[2-(4-fluoroanilino)-2-oxo-ethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[2-(4-fluoroanilino)-2-keto-ethyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C17H11FN3O4- MolecularWeight: 340.285343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])F

InChI

InChI=1S/C17H12FN3O4/c18-10-2-4-11(5-3-10)19-15(22)8-14-20-13-7-9(17(24)25)1-6-12(13)16(23)21-14/h1-7H,8H2,(H,19,22)(H,24,25)(H,20,21,23)/p-1