ethyl 2-[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-methoxy-6-nitro-phenoxy]propanoate

Systemtic Name: ethyl 2-[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-methoxy-6-nitro-phenoxy]propanoate Openeye Name: ethyl 2-[4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-methoxy-6-nitro-phenoxy]propanoate CAS Name: 2-[4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-methoxy-6-nitrophenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-methoxy-6-nitrophenoxy]propanoate Traditional Name: 2-[4-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-2-methoxy-6-nitro-phenoxy]propionic acid ethyl ester Formula: C21H20N4O8 MolecularWeight: 456.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=C(C=C(C=C1OC)C=NN2C(=O)C3=CC=CC=C3NC2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)OC1=C(C=C(C=C1OC)C=NN2C(=O)C3=CC=CC=C3NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O8/c1-4-32-20(27)12(2)33-18-16(25(29)30)9-13(10-17(18)31-3)11-22-24-19(26)14-7-5-6-8-15(14)23-21(24)28/h5-12H,4H2,1-3H3,(H,23,28)