[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2,6-bis(fluoranyl)benzoate

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2,6-bis(fluoranyl)benzoate Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C18H13F2N3O4 MolecularWeight: 373.310326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)COC(=O)C3=C(C=CC=C3F)F)CC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)COC(=O)C3=C(C=CC=C3F)F)CC(=O)N

InChI

InChI=1S/C18H13F2N3O4/c19-11-5-3-6-12(20)16(11)18(26)27-9-15-22-13-7-2-1-4-10(13)17(25)23(15)8-14(21)24/h1-7H,8-9H2,(H2,21,24)