(E)-phenyl-[5-(phenylcarbonyl)pyrazolo[1,2-a]pyrazol-4-ium-7-ylidene]methanolate

Systemtic Name: (E)-phenyl-[5-(phenylcarbonyl)pyrazolo[1,2-a]pyrazol-4-ium-7-ylidene]methanolate Openeye Name: (E)-(5-benzoylpyrazolo[1,2-a]pyrazol-4-ium-7-ylidene)-phenyl-methanolate CAS Name: (E)-(5-benzoyl-7-pyrazolo[1,2-a]pyrazol-4-iumylidene)-phenylmethanolate IUPAC Name: (E)-(5-benzoylpyrazolo[1,2-a]pyrazol-4-ium-7-ylidene)-phenylmethanolate Traditional Name: (E)-(5-benzoylpyrazolo[1,2-a]pyrazol-4-ium-7-ylidene)-phenyl-methanolate Formula: C20H14N2O2 MolecularWeight: 314.33736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C3=CC=CC=C3)[O-])N4[N+]2=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C/C(=C(/C3=CC=CC=C3)\[O-])/N4[N+]2=CC=C4

InChI

InChI=1S/C20H14N2O2/c23-19(15-8-3-1-4-9-15)17-14-18(22-13-7-12-21(17)22)20(24)16-10-5-2-6-11-16/h1-14H