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

Systemtic Name: (E)-3-[5-(4-chloranyl-3-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(4-chloro-3-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[5-(4-chloro-3-methylphenoxy)-1,3-dimethyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[5-(4-chloro-3-methylphenoxy)-1,3-dimethylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(4-chloro-3-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]acrylic acid Formula: C15H15ClN2O3 MolecularWeight: 306.7442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=NN2C)C)C=CC(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=NN2C)C)/C=C/C(=O)O)Cl

InChI

InChI=1S/C15H15ClN2O3/c1-9-8-11(4-6-13(9)16)21-15-12(5-7-14(19)20)10(2)17-18(15)3/h4-8H,1-3H3,(H,19,20)/b7-5+