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

Systemtic Name: 2-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-bromanyl-6-methoxy-phenoxy]propanoic acid Openeye Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methoxy-phenoxy]propanoic acid CAS Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methoxyphenoxy]propanoic acid IUPAC Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methoxyphenoxy]propanoic acid Traditional Name: 2-[4-bromo-2-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-6-methoxy-phenoxy]propionic acid Formula: C19H16BrN3O6 MolecularWeight: 462.25084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=C(C=C1C=NN2C(=O)C3=CC=CC=C3NC2=O)Br)OC

Isomeric SMILES

CC(C(=O)O)OC1=C(C=C(C=C1C=NN2C(=O)C3=CC=CC=C3NC2=O)Br)OC

InChI

InChI=1S/C19H16BrN3O6/c1-10(18(25)26)29-16-11(7-12(20)8-15(16)28-2)9-21-23-17(24)13-5-3-4-6-14(13)22-19(23)27/h3-10H,1-2H3,(H,22,27)(H,25,26)