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

Systemtic Name: methyl 2-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-bromanyl-6-nitro-phenoxy]propanoate Openeye Name: methyl 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-nitro-phenoxy]propanoate CAS Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-nitrophenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-nitrophenoxy]propanoate Traditional Name: 2-[4-bromo-2-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-6-nitro-phenoxy]propionic acid methyl ester Formula: C19H15BrN4O7 MolecularWeight: 491.249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=C(C=C(C=C1C=NN2C(=O)C3=CC=CC=C3NC2=O)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC)OC1=C(C=C(C=C1C=NN2C(=O)C3=CC=CC=C3NC2=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H15BrN4O7/c1-10(18(26)30-2)31-16-11(7-12(20)8-15(16)24(28)29)9-21-23-17(25)13-5-3-4-6-14(13)22-19(23)27/h3-10H,1-2H3,(H,22,27)