(E)-3-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]-2-propenoic acid IUPAC Name: (E)-3-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]acrylic acid Formula: C12H9ClN2O2 MolecularWeight: 248.66506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=C(C=NN2)C=CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=C(C=NN2)/C=C/C(=O)O

InChI

InChI=1S/C12H9ClN2O2/c13-10-3-1-2-8(6-10)12-9(7-14-15-12)4-5-11(16)17/h1-7H,(H,14,15)(H,16,17)/b5-4+