[2-(oxidanylidenemethylidene)-3,4-dihydropyrazol-2-ium-4-yl] benzoate

Systemtic Name: [2-(oxidanylidenemethylidene)-3,4-dihydropyrazol-2-ium-4-yl] benzoate Openeye Name: [2-(oxomethylene)-3,4-dihydropyrazol-2-ium-4-yl] benzoate CAS Name: benzoic acid [2-(oxomethylidene)-3,4-dihydropyrazol-2-ium-4-yl] ester IUPAC Name: [2-(oxomethylidene)-3,4-dihydropyrazol-2-ium-4-yl] benzoate Traditional Name: benzoic acid [1-(ketomethylene)-2-pyrazolin-1-ium-4-yl] ester Formula: C11H9N2O3+ MolecularWeight: 217.20076

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=N[N+]1=C=O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C1C(C=N[N+]1=C=O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C11H9N2O3/c14-8-13-7-10(6-12-13)16-11(15)9-4-2-1-3-5-9/h1-6,10H,7H2/q+1