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

Systemtic Name: (E)-3-[1-(2-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-(2-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[1-(2-chlorophenyl)-3,5-dimethyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-(2-chlorophenyl)-3,5-dimethylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[1-(2-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]acrylic acid Formula: C14H13ClN2O2 MolecularWeight: 276.71822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2Cl)C)C=CC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2Cl)C)/C=C/C(=O)O

InChI

InChI=1S/C14H13ClN2O2/c1-9-11(7-8-14(18)19)10(2)17(16-9)13-6-4-3-5-12(13)15/h3-8H,1-2H3,(H,18,19)/b8-7+