ethoxy-[2-(4-iodophenyl)-7-oxidanylidene-pyrazolo[1,5-a]pyrimidin-6-ylidene]methanolate

Systemtic Name: ethoxy-[2-(4-iodophenyl)-7-oxidanylidene-pyrazolo[1,5-a]pyrimidin-6-ylidene]methanolate Openeye Name: ethoxy-[2-(4-iodophenyl)-7-oxo-pyrazolo[1,5-a]pyrimidin-6-ylidene]methanolate CAS Name: ethoxy-[2-(4-iodophenyl)-7-oxo-6-pyrazolo[1,5-a]pyrimidinylidene]methanolate IUPAC Name: ethoxy-[2-(4-iodophenyl)-7-oxopyrazolo[1,5-a]pyrimidin-6-ylidene]methanolate Traditional Name: ethoxy-[2-(4-iodophenyl)-7-keto-pyrazolo[1,5-a]pyrimidin-6-ylidene]methanolate Formula: C15H11IN3O3- MolecularWeight: 408.17061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1C=NC2=CC(=NN2C1=O)C3=CC=C(C=C3)I)[O-]

Isomeric SMILES

CCOC(=C1C=NC2=CC(=NN2C1=O)C3=CC=C(C=C3)I)[O-]

InChI

InChI=1S/C15H12IN3O3/c1-2-22-15(21)11-8-17-13-7-12(18-19(13)14(11)20)9-3-5-10(16)6-4-9/h3-8,21H,2H2,1H3/p-1