5-(3-oxidanylpropoxy)-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(3-oxidanylpropoxy)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-(3-hydroxypropoxy)-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-(3-hydroxypropoxy)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(3-hydroxypropoxy)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-(3-hydroxypropoxy)-1-phenyl-pyrazole-4-carboxylic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

Click to see the large picture

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