4-[(1-methoxypyridin-1-ium-2-yl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 4-[(1-methoxypyridin-1-ium-2-yl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one Openeye Name: 4-(1-methoxypyridin-1-ium-2-yl)azo-5-methyl-2-phenyl-4H-pyrazol-3-one CAS Name: 4-[(1-methoxy-2-pyridin-1-iumyl)azo]-5-methyl-2-phenyl-4H-pyrazol-3-one IUPAC Name: 4-[(1-methoxypyridin-1-ium-2-yl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one Traditional Name: 4-(1-methoxypyridin-1-ium-2-yl)azo-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C16H16N5O2+ MolecularWeight: 310.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=CC=[N+]2OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=CC=[N+]2OC)C3=CC=CC=C3

InChI

InChI=1S/C16H16N5O2/c1-12-15(18-17-14-10-6-7-11-20(14)23-2)16(22)21(19-12)13-8-4-3-5-9-13/h3-11,15H,1-2H3/q+1