methyl 2-[2-methyl-4-[(E)-phenylcarbonyloxyiminomethyl]-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate

Systemtic Name: methyl 2-[2-methyl-4-[(E)-phenylcarbonyloxyiminomethyl]-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate Openeye Name: methyl 2-[4-[(E)-benzoyloxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate CAS Name: 2-[[4-[(E)-benzoyloxyiminomethyl]-2-methyl-5-(trifluoromethyl)-3-pyrazolyl]thio]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-benzoyloxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate Traditional Name: 2-[[4-[(E)-benzoyloximinomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]thio]benzoic acid methyl ester Formula: C21H16F3N3O4S MolecularWeight: 463.42965

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)C=NOC(=O)C2=CC=CC=C2)SC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)/C=N/OC(=O)C2=CC=CC=C2)SC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H16F3N3O4S/c1-27-18(32-16-11-7-6-10-14(16)20(29)30-2)15(17(26-27)21(22,23)24)12-25-31-19(28)13-8-4-3-5-9-13/h3-12H,1-2H3/b25-12+