2-[(6,7-dimethoxy-2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitro-phenolate

Systemtic Name: 2-[(6,7-dimethoxy-2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitro-phenolate Openeye Name: 2-[(6,7-dimethoxy-2-methyl-4-oxo-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitro-phenolate CAS Name: 2-[(6,7-dimethoxy-2-methyl-4-oxo-3-quinazolinyl)iminomethyl]-6-methyl-4-nitrophenolate IUPAC Name: 2-[(6,7-dimethoxy-2-methyl-4-oxoquinazolin-3-yl)iminomethyl]-6-methyl-4-nitrophenolate Traditional Name: 2-[(4-keto-6,7-dimethoxy-2-methyl-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitro-phenolate Formula: C19H17N4O6- MolecularWeight: 397.36148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)[N+](=O)[O-])C=NN2C(=NC3=CC(=C(C=C3C2=O)OC)OC)C)[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1)[N+](=O)[O-])C=NN2C(=NC3=CC(=C(C=C3C2=O)OC)OC)C)[O-]

InChI

InChI=1S/C19H18N4O6/c1-10-5-13(23(26)27)6-12(18(10)24)9-20-22-11(2)21-15-8-17(29-4)16(28-3)7-14(15)19(22)25/h5-9,24H,1-4H3/p-1