(E)-3-[1-(4-bromophenyl)-5-chloranyl-3-methyl-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-(4-bromophenyl)-5-chloranyl-3-methyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-(4-bromophenyl)-5-chloro-3-methyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[1-(4-bromophenyl)-5-chloro-3-methyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-(4-bromophenyl)-5-chloro-3-methylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[1-(4-bromophenyl)-5-chloro-3-methyl-pyrazol-4-yl]acrylic acid Formula: C13H10BrClN2O2 MolecularWeight: 341.5877

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)O)Cl)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)O)Cl)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H10BrClN2O2/c1-8-11(6-7-12(18)19)13(15)17(16-8)10-4-2-9(14)3-5-10/h2-7H,1H3,(H,18,19)/b7-6+