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

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-chloranyl-4-nitro-benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-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)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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