5-ethyl-1-[2-(oxan-2-yloxy)ethyl]pyrazole-3-carboxylic acid

Systemtic Name: 5-ethyl-1-[2-(oxan-2-yloxy)ethyl]pyrazole-3-carboxylic acid Openeye Name: 5-ethyl-1-(2-tetrahydropyran-2-yloxyethyl)pyrazole-3-carboxylic acid CAS Name: 5-ethyl-1-[2-(2-oxanyloxy)ethyl]-3-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-1-[2-(oxan-2-yloxy)ethyl]pyrazole-3-carboxylic acid Traditional Name: 5-ethyl-1-(2-tetrahydropyran-2-yloxyethyl)pyrazole-3-carboxylic acid Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1CCOC2CCCCO2)C(=O)O

Isomeric SMILES

CCC1=CC(=NN1CCOC2CCCCO2)C(=O)O

InChI

InChI=1S/C13H20N2O4/c1-2-10-9-11(13(16)17)14-15(10)6-8-19-12-5-3-4-7-18-12/h9,12H,2-8H2,1H3,(H,16,17)