4-chloranyl-1-[(4-chloranyl-3-ethyl-phenoxy)methyl]pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-1-[(4-chloranyl-3-ethyl-phenoxy)methyl]pyrazole-3-carboxylic acid Openeye Name: 4-chloro-1-[(4-chloro-3-ethyl-phenoxy)methyl]pyrazole-3-carboxylic acid CAS Name: 4-chloro-1-[(4-chloro-3-ethylphenoxy)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-1-[(4-chloro-3-ethylphenoxy)methyl]pyrazole-3-carboxylic acid Traditional Name: 4-chloro-1-[(4-chloro-3-ethyl-phenoxy)methyl]pyrazole-3-carboxylic acid Formula: C13H12Cl2N2O3 MolecularWeight: 315.15198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCN2C=C(C(=N2)C(=O)O)Cl)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OCN2C=C(C(=N2)C(=O)O)Cl)Cl

InChI

InChI=1S/C13H12Cl2N2O3/c1-2-8-5-9(3-4-10(8)14)20-7-17-6-11(15)12(16-17)13(18)19/h3-6H,2,7H2,1H3,(H,18,19)