4-[(E)-3-chloranylprop-2-enoxy]-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[(E)-3-chloranylprop-2-enoxy]-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-[(E)-3-chloroallyloxy]-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-[(E)-3-chloroprop-2-enoxy]-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[(E)-3-chloroprop-2-enoxy]-1-phenylpyrazole-3-carboxylic acid Traditional Name: 4-[(E)-3-chloroallyloxy]-1-phenyl-pyrazole-3-carboxylic acid Formula: C13H11ClN2O3 MolecularWeight: 278.69104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)OCC=CCl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)OC/C=C/Cl

InChI

InChI=1S/C13H11ClN2O3/c14-7-4-8-19-11-9-16(15-12(11)13(17)18)10-5-2-1-3-6-10/h1-7,9H,8H2,(H,17,18)/b7-4+