[3-[(5-azanyl-3-oxidanylidene-1H-pyrazol-2-yl)methyl]phenyl]-methanoyl-dimethyl-azanium

Systemtic Name: [3-[(5-azanyl-3-oxidanylidene-1H-pyrazol-2-yl)methyl]phenyl]-methanoyl-dimethyl-azanium Openeye Name: [3-[(5-amino-3-oxo-1H-pyrazol-2-yl)methyl]phenyl]-formyl-dimethyl-ammonium CAS Name: [3-[(5-amino-3-oxo-1H-pyrazol-2-yl)methyl]phenyl]-formyl-dimethylammonium IUPAC Name: [3-[(5-amino-3-oxo-1H-pyrazol-2-yl)methyl]phenyl]-formyl-dimethylazanium Traditional Name: [3-[(3-amino-5-keto-3-pyrazolin-1-yl)methyl]phenyl]-formyl-dimethyl-ammonium Formula: C13H17N4O2+ MolecularWeight: 261.29968

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C=O)C1=CC=CC(=C1)CN2C(=O)C=C(N2)N

Isomeric SMILES

C[N+](C)(C=O)C1=CC=CC(=C1)CN2C(=O)C=C(N2)N

InChI

InChI=1S/C13H16N4O2/c1-17(2,9-18)11-5-3-4-10(6-11)8-16-13(19)7-12(14)15-16/h3-7,9H,8H2,1-2H3,(H2-,14,15,19)/p+1