[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-iodanyl-phenyl] ethanoate

Systemtic Name: [4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-iodanyl-phenyl] ethanoate Openeye Name: [4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-iodo-phenyl] acetate CAS Name: acetic acid [4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-iodophenyl] ester IUPAC Name: [4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-iodophenyl] acetate Traditional Name: acetic acid [4-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-2-iodo-phenyl] ester Formula: C17H12IN3O4 MolecularWeight: 449.19935

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=NN2C(=O)C3=CC=CC=C3NC2=O)I

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C=NN2C(=O)C3=CC=CC=C3NC2=O)I

InChI

InChI=1S/C17H12IN3O4/c1-10(22)25-15-7-6-11(8-13(15)18)9-19-21-16(23)12-4-2-3-5-14(12)20-17(21)24/h2-9H,1H3,(H,20,24)