2-(1-ethyl-3,4-diphenyl-pyrazol-1-ium-1-yl)ethanoate; methane

Systemtic Name: 2-(1-ethyl-3,4-diphenyl-pyrazol-1-ium-1-yl)ethanoate; methane Openeye Name: 2-(1-ethyl-3,4-diphenyl-pyrazol-1-ium-1-yl)acetate; methane CAS Name: 2-(1-ethyl-3,4-diphenyl-1-pyrazol-1-iumyl)acetate; methane IUPAC Name: 2-(1-ethyl-3,4-diphenylpyrazol-1-ium-1-yl)acetate; methane Traditional Name: 2-(1-ethyl-3,4-diphenyl-pyrazol-1-ium-1-yl)acetate; methane Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

C.CC[N+]1(C=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)[O-]

Isomeric SMILES

C.CC[N+]1(C=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)[O-]

InChI

InChI=1S/C19H18N2O2.CH4/c1-2-21(14-18(22)23)13-17(15-9-5-3-6-10-15)19(20-21)16-11-7-4-8-12-16;/h3-13H,2,14H2,1H3;1H4