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

Systemtic Name: 1-[(E)-3-chloranylprop-2-enyl]pyrazole-4-carboxylic acid Openeye Name: 1-[(E)-3-chloroallyl]pyrazole-4-carboxylic acid CAS Name: 1-[(E)-3-chloroprop-2-enyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[(E)-3-chloroprop-2-enyl]pyrazole-4-carboxylic acid Traditional Name: 1-[(E)-3-chloroallyl]pyrazole-4-carboxylic acid Formula: C7H7ClN2O2 MolecularWeight: 186.59568

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CC=CCl)C(=O)O

Isomeric SMILES

C1=C(C=NN1C/C=C/Cl)C(=O)O

InChI

InChI=1S/C7H7ClN2O2/c8-2-1-3-10-5-6(4-9-10)7(11)12/h1-2,4-5H,3H2,(H,11,12)/b2-1+