2-[(E)-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-6-methyl-4-nitro-phenolate

Systemtic Name: 2-[(E)-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-6-methyl-4-nitro-phenolate Openeye Name: 2-[(E)-(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitro-phenolate CAS Name: 2-[(E)-(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitrophenolate IUPAC Name: 2-[(E)-(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitrophenolate Traditional Name: 2-[(E)-(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-6-methyl-4-nitro-phenolate Formula: C16H11N4O5- MolecularWeight: 339.28234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)[N+](=O)[O-])C=NN2C(=O)C3=CC=CC=C3NC2=O)[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1)[N+](=O)[O-])/C=N/N2C(=O)C3=CC=CC=C3NC2=O)[O-]

InChI

InChI=1S/C16H12N4O5/c1-9-6-11(20(24)25)7-10(14(9)21)8-17-19-15(22)12-4-2-3-5-13(12)18-16(19)23/h2-8,21H,1H3,(H,18,23)/p-1/b17-8+