2-(2-ethoxyethoxycarbonyl)-5-[(2E)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 2-(2-ethoxyethoxycarbonyl)-5-[(2E)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzoic acid Openeye Name: 2-(2-ethoxyethoxycarbonyl)-5-[(2E)-2-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazino]benzoic acid CAS Name: 2-[2-ethoxyethoxy(oxo)methyl]-5-[(2E)-2-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinyl]benzoic acid IUPAC Name: 2-(2-ethoxyethoxycarbonyl)-5-[(2E)-2-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinyl]benzoic acid Traditional Name: 2-(2-ethoxyethoxycarbonyl)-5-[(N'E)-N'-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]benzoic acid Formula: C22H22N4O6 MolecularWeight: 438.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=C(C=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=CC=C3)C)C(=O)O

Isomeric SMILES

CCOCCOC(=O)C1=C(C=C(C=C1)N/N=C/2\C(=NN(C2=O)C3=CC=CC=C3)C)C(=O)O

InChI

InChI=1S/C22H22N4O6/c1-3-31-11-12-32-22(30)17-10-9-15(13-18(17)21(28)29)23-24-19-14(2)25-26(20(19)27)16-7-5-4-6-8-16/h4-10,13,23H,3,11-12H2,1-2H3,(H,28,29)/b24-19+