(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(4-chloranyl-2-nitro-phenoxy)benzoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(4-chloranyl-2-nitro-phenoxy)benzoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-(4-chloro-2-nitro-phenoxy)benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)benzoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-(4-chloro-2-nitrophenoxy)benzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)benzoic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C22H13Cl2N3O6 MolecularWeight: 486.26112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H13Cl2N3O6/c23-13-3-7-16-17(9-13)25-20(26-21(16)28)11-32-22(29)12-1-5-15(6-2-12)33-19-8-4-14(24)10-18(19)27(30)31/h1-10H,11H2,(H,25,26,28)