2-(1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium-4-yl)ethanoic acid

Systemtic Name: 2-(1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium-4-yl)ethanoic acid Openeye Name: 2-(1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium-4-yl)acetic acid CAS Name: 2-(1,2-dimethyl-3,5-diphenyl-4-pyrazol-1-iumyl)acetic acid IUPAC Name: 2-(1,2-dimethyl-3,5-diphenylpyrazol-1-ium-4-yl)acetic acid Traditional Name: 2-(1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium-4-yl)acetic acid Formula: C19H19N2O2+ MolecularWeight: 307.36636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=[N+]1C)C2=CC=CC=C2)CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=[N+]1C)C2=CC=CC=C2)CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2/c1-20-18(14-9-5-3-6-10-14)16(13-17(22)23)19(21(20)2)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3/p+1