2,5-dimethyl-1-phenyl-pyrazol-2-ium-3-carboxylate

Systemtic Name: 2,5-dimethyl-1-phenyl-pyrazol-2-ium-3-carboxylate Openeye Name: 2,5-dimethyl-1-phenyl-pyrazol-2-ium-3-carboxylate CAS Name: 2,5-dimethyl-1-phenyl-3-pyrazol-2-iumcarboxylate IUPAC Name: 2,5-dimethyl-1-phenylpyrazol-2-ium-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenyl-pyrazol-2-ium-3-carboxylate Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1C2=CC=CC=C2)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=[N+](N1C2=CC=CC=C2)C)C(=O)[O-]

InChI

InChI=1S/C12H12N2O2/c1-9-8-11(12(15)16)13(2)14(9)10-6-4-3-5-7-10/h3-8H,1-2H3