(4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-methoxy-3-nitro-benzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-methoxy-3-nitro-benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C17H13N3O6 MolecularWeight: 355.30162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6/c1-25-14-7-6-10(8-13(14)20(23)24)17(22)26-9-15-18-12-5-3-2-4-11(12)16(21)19-15/h2-8H,9H2,1H3,(H,18,19,21)