1-phenyl-5-propoxy-pyrazole-4-carboxylic acid

Systemtic Name: 1-phenyl-5-propoxy-pyrazole-4-carboxylic acid Openeye Name: 1-phenyl-5-propoxy-pyrazole-4-carboxylic acid CAS Name: 1-phenyl-5-propoxy-4-pyrazolecarboxylic acid IUPAC Name: 1-phenyl-5-propoxypyrazole-4-carboxylic acid Traditional Name: 1-phenyl-5-propoxy-pyrazole-4-carboxylic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=NN1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCOC1=C(C=NN1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H14N2O3/c1-2-8-18-12-11(13(16)17)9-14-15(12)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,16,17)