2-methyl-2-(phenylmethyl)-4H-pyrazol-2-ium-3-one

Systemtic Name: 2-methyl-2-(phenylmethyl)-4H-pyrazol-2-ium-3-one Openeye Name: 2-benzyl-2-methyl-4H-pyrazol-2-ium-3-one CAS Name: 2-methyl-2-(phenylmethyl)-4H-pyrazol-2-ium-3-one IUPAC Name: 2-benzyl-2-methyl-4H-pyrazol-2-ium-3-one Traditional Name: 2-benzyl-2-methyl-2-pyrazolin-2-ium-3-one Formula: C11H13N2O+ MolecularWeight: 189.23372

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)CC=N1)CC2=CC=CC=C2

Isomeric SMILES

C[N+]1(C(=O)CC=N1)CC2=CC=CC=C2

InChI

InChI=1S/C11H13N2O/c1-13(11(14)7-8-12-13)9-10-5-3-2-4-6-10/h2-6,8H,7,9H2,1H3/q+1