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

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-chloranyl-2-nitro-benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-chloro-2-nitro-benzoate CAS Name: 4-chloro-2-nitrobenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-chloro-2-nitrobenzoate Traditional Name: 4-chloro-2-nitro-benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C16H10ClN3O5 MolecularWeight: 359.7207

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClN3O5/c17-9-5-6-11(13(7-9)20(23)24)16(22)25-8-14-18-12-4-2-1-3-10(12)15(21)19-14/h1-7H,8H2,(H,18,19,21)