(4Z)-4-[(4-ethoxyphenyl)hydrazinylidene]-2-(1-oxidanidylpyridin-1-ium-3-yl)carbonyl-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[(4-ethoxyphenyl)hydrazinylidene]-2-(1-oxidanidylpyridin-1-ium-3-yl)carbonyl-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[(4-ethoxyphenyl)hydrazono]-2-(1-oxidopyridin-1-ium-3-carbonyl)-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[(4-ethoxyphenyl)hydrazinylidene]-2-[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[(4-ethoxyphenyl)hydrazinylidene]-2-(1-oxidopyridin-1-ium-3-carbonyl)-5-propylpyrazol-3-one Traditional Name: (4Z)-2-(1-oxidopyridin-1-ium-3-carbonyl)-4-(p-phenetylhydrazono)-5-propyl-2-pyrazolin-3-one Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=NNC2=CC=C(C=C2)OCC)C(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=N\NC2=CC=C(C=C2)OCC)C(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C20H21N5O4/c1-3-6-17-18(22-21-15-8-10-16(11-9-15)29-4-2)20(27)25(23-17)19(26)14-7-5-12-24(28)13-14/h5,7-13,21H,3-4,6H2,1-2H3/b22-18-