2,2,4-trimethyl-5-phenyl-1H-pyrazol-2-ium-3-one

Systemtic Name: 2,2,4-trimethyl-5-phenyl-1H-pyrazol-2-ium-3-one Openeye Name: 2,2,4-trimethyl-5-phenyl-1H-pyrazol-2-ium-3-one CAS Name: 2,2,4-trimethyl-5-phenyl-1H-pyrazol-2-ium-3-one IUPAC Name: 2,2,4-trimethyl-5-phenyl-1H-pyrazol-2-ium-3-one Traditional Name: 2,2,4-trimethyl-5-phenyl-3-pyrazolin-2-ium-3-one Formula: C12H15N2O+ MolecularWeight: 203.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N[N+](C1=O)(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=C(N[N+](C1=O)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C12H14N2O/c1-9-11(10-7-5-4-6-8-10)13-14(2,3)12(9)15/h4-8H,1-3H3/p+1