2-methoxy-4-[(2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-methoxy-4-[(2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[(2-methyl-4-oxo-quinazolin-3-yl)iminomethyl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[(2-methyl-4-oxo-3-quinazolinyl)iminomethyl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(2-methyl-4-oxoquinazolin-3-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-[(4-keto-2-methyl-quinazolin-3-yl)iminomethyl]-2-methoxy-6-nitro-phenolate Formula: C17H13N4O5- MolecularWeight: 353.30892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O5/c1-10-19-13-6-4-3-5-12(13)17(23)20(10)18-9-11-7-14(21(24)25)16(22)15(8-11)26-2/h3-9,22H,1-2H3/p-1