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

Systemtic Name: 3-[[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-chloranyl-6-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-chloro-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methoxy-phenoxy]methyl]benzoic acid CAS Name: 3-[[4-chloro-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-chloro-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-methoxyphenoxy]methyl]benzoic acid Traditional Name: 3-[[4-chloro-2-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-6-methoxy-phenoxy]methyl]benzoic acid Formula: C24H18ClN3O6 MolecularWeight: 479.86922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Cl)C=NN2C(=O)C3=CC=CC=C3NC2=O)OCC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)Cl)C=NN2C(=O)C3=CC=CC=C3NC2=O)OCC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C24H18ClN3O6/c1-33-20-11-17(25)10-16(21(20)34-13-14-5-4-6-15(9-14)23(30)31)12-26-28-22(29)18-7-2-3-8-19(18)27-24(28)32/h2-12H,13H2,1H3,(H,27,32)(H,30,31)