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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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