2-[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-bromanyl-6-ethoxy-phenoxy]propanoic acid

Systemtic Name: 2-[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-bromanyl-6-ethoxy-phenoxy]propanoic acid Openeye Name: 2-[2-bromo-4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-ethoxy-phenoxy]propanoic acid CAS Name: 2-[2-bromo-4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-ethoxyphenoxy]propanoic acid IUPAC Name: 2-[2-bromo-4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-ethoxyphenoxy]propanoic acid Traditional Name: 2-[2-bromo-4-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-6-ethoxy-phenoxy]propionic acid Formula: C20H18BrN3O6 MolecularWeight: 476.27742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NN2C(=O)C3=CC=CC=C3NC2=O)Br)OC(C)C(=O)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NN2C(=O)C3=CC=CC=C3NC2=O)Br)OC(C)C(=O)O

InChI

InChI=1S/C20H18BrN3O6/c1-3-29-16-9-12(8-14(21)17(16)30-11(2)19(26)27)10-22-24-18(25)13-6-4-5-7-15(13)23-20(24)28/h4-11H,3H2,1-2H3,(H,23,28)(H,26,27)