2-[3-(3-chlorophenyl)-1-ethyl-pyrazol-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[3-(3-chlorophenyl)-1-ethyl-pyrazol-1-ium-1-yl]ethanoic acid Openeye Name: 2-[3-(3-chlorophenyl)-1-ethyl-pyrazol-1-ium-1-yl]acetic acid CAS Name: 2-[3-(3-chlorophenyl)-1-ethyl-1-pyrazol-1-iumyl]acetic acid IUPAC Name: 2-[3-(3-chlorophenyl)-1-ethylpyrazol-1-ium-1-yl]acetic acid Traditional Name: 2-[3-(3-chlorophenyl)-1-ethyl-pyrazol-1-ium-1-yl]acetic acid Formula: C13H14ClN2O2+ MolecularWeight: 265.71546

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=CC(=N1)C2=CC(=CC=C2)Cl)CC(=O)O

Isomeric SMILES

CC[N+]1(C=CC(=N1)C2=CC(=CC=C2)Cl)CC(=O)O

InChI

InChI=1S/C13H13ClN2O2/c1-2-16(9-13(17)18)7-6-12(15-16)10-4-3-5-11(14)8-10/h3-8H,2,9H2,1H3/p+1