2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[4-(difluoromethoxy)-3-methoxy-benzyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C18H13F2N2O5- MolecularWeight: 375.303026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])OC(F)F

InChI

InChI=1S/C18H14F2N2O5/c1-26-14-6-9(2-5-13(14)27-18(19)20)7-15-21-12-8-10(17(24)25)3-4-11(12)16(23)22-15/h2-6,8,18H,7H2,1H3,(H,24,25)(H,21,22,23)/p-1