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

Systemtic Name: 4-azanyl-2,2-dimethyl-5-phenyl-1H-pyrazol-2-ium-3-one Openeye Name: 4-amino-2,2-dimethyl-5-phenyl-1H-pyrazol-2-ium-3-one CAS Name: 4-amino-2,2-dimethyl-5-phenyl-1H-pyrazol-2-ium-3-one IUPAC Name: 4-amino-2,2-dimethyl-5-phenyl-1H-pyrazol-2-ium-3-one Traditional Name: 4-amino-2,2-dimethyl-5-phenyl-3-pyrazolin-2-ium-3-one Formula: C11H14N3O+ MolecularWeight: 204.24836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O/c1-14(2)11(15)9(12)10(13-14)8-6-4-3-5-7-8/h3-7H,12H2,1-2H3/p+1