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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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