methyl 4-oxidanylidene-2-[[2,4,5-tris(chloranyl)phenoxy]methyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[[2,4,5-tris(chloranyl)phenoxy]methyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[(2,4,5-trichlorophenoxy)methyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[(2,4,5-trichlorophenoxy)methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[(2,4,5-trichlorophenoxy)methyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[(2,4,5-trichlorophenoxy)methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C17H11Cl3N2O4 MolecularWeight: 413.63924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC3=CC(=C(C=C3Cl)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC3=CC(=C(C=C3Cl)Cl)Cl

InChI

InChI=1S/C17H11Cl3N2O4/c1-25-17(24)8-2-3-9-13(4-8)21-15(22-16(9)23)7-26-14-6-11(19)10(18)5-12(14)20/h2-6H,7H2,1H3,(H,21,22,23)