(5-chloranyl-1-methyl-3-phenyl-pyrazol-4-yl)methyl 3,4-bis(chloranyl)benzoate

Systemtic Name: (5-chloranyl-1-methyl-3-phenyl-pyrazol-4-yl)methyl 3,4-bis(chloranyl)benzoate Openeye Name: (5-chloro-1-methyl-3-phenyl-pyrazol-4-yl)methyl 3,4-dichlorobenzoate CAS Name: 3,4-dichlorobenzoic acid (5-chloro-1-methyl-3-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-1-methyl-3-phenylpyrazol-4-yl)methyl 3,4-dichlorobenzoate Traditional Name: 3,4-dichlorobenzoic acid (5-chloro-1-methyl-3-phenyl-pyrazol-4-yl)methyl ester Formula: C18H13Cl3N2O2 MolecularWeight: 395.66702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)COC(=O)C3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)COC(=O)C3=CC(=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C18H13Cl3N2O2/c1-23-17(21)13(16(22-23)11-5-3-2-4-6-11)10-25-18(24)12-7-8-14(19)15(20)9-12/h2-9H,10H2,1H3