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

Systemtic Name: 3-[5-chloranyl-1-[(2,4-dichlorophenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: 3-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: 3-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-3-methyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: 3-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-3-methylpyrazol-4-yl]prop-2-enoic acid Traditional Name: 3-[5-chloro-1-(2,4-dichlorobenzyl)-3-methyl-pyrazol-4-yl]acrylic acid Formula: C14H11Cl3N2O2 MolecularWeight: 345.60834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)O)Cl)CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)O)Cl)CC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H11Cl3N2O2/c1-8-11(4-5-13(20)21)14(17)19(18-8)7-9-2-3-10(15)6-12(9)16/h2-6H,7H2,1H3,(H,20,21)