4-(3-oxidanylpropoxy)-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-(3-oxidanylpropoxy)-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-(3-hydroxypropoxy)-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-(3-hydroxypropoxy)-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-(3-hydroxypropoxy)-1-phenylpyrazole-3-carboxylic acid Traditional Name: 4-(3-hydroxypropoxy)-1-phenyl-pyrazole-3-carboxylic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)OCCCO

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)OCCCO

InChI

InChI=1S/C13H14N2O4/c16-7-4-8-19-11-9-15(14-12(11)13(17)18)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,7-8H2,(H,17,18)