3-[3-(3,4-dimethoxyphenyl)-4-(hydroxyiminomethyl)pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[3-(3,4-dimethoxyphenyl)-4-(hydroxyiminomethyl)pyrazol-1-yl]propanoic acid Openeye Name: 3-[3-(3,4-dimethoxyphenyl)-4-(hydroxyiminomethyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[3-(3,4-dimethoxyphenyl)-4-(hydroxyiminomethyl)-1-pyrazolyl]propanoic acid IUPAC Name: 3-[3-(3,4-dimethoxyphenyl)-4-(hydroxyiminomethyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[3-(3,4-dimethoxyphenyl)-4-(hydroximinomethyl)pyrazol-1-yl]propionic acid Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=NO)CCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C=NO)CCC(=O)O)OC

InChI

InChI=1S/C15H17N3O5/c1-22-12-4-3-10(7-13(12)23-2)15-11(8-16-21)9-18(17-15)6-5-14(19)20/h3-4,7-9,21H,5-6H2,1-2H3,(H,19,20)