4-[[[3-(2,5-dimethoxyphenyl)-1H-pyrazol-5-yl]carbonylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[[[3-(2,5-dimethoxyphenyl)-1H-pyrazol-5-yl]carbonylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[[[3-(2,5-dimethoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazono]methyl]benzoic acid CAS Name: 4-[[[[3-(2,5-dimethoxyphenyl)-1H-pyrazol-5-yl]-oxomethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[[[3-(2,5-dimethoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[[[3-(2,5-dimethoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazono]methyl]benzoic acid Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N4O5/c1-28-14-7-8-18(29-2)15(9-14)16-10-17(23-22-16)19(25)24-21-11-12-3-5-13(6-4-12)20(26)27/h3-11H,1-2H3,(H,22,23)(H,24,25)(H,26,27)