ethyl 3,4-bis(chloranyl)-5-cyclopropyl-2-(4-methylsulfanylphenyl)carbonyl-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 3,4-bis(chloranyl)-5-cyclopropyl-2-(4-methylsulfanylphenyl)carbonyl-1,2-oxazole-3-carboxylate Openeye Name: ethyl 3,4-dichloro-5-cyclopropyl-2-(4-methylsulfanylbenzoyl)isoxazole-3-carboxylate CAS Name: 3,4-dichloro-5-cyclopropyl-2-[[4-(methylthio)phenyl]-oxomethyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3,4-dichloro-5-cyclopropyl-2-(4-methylsulfanylbenzoyl)-1,2-oxazole-3-carboxylate Traditional Name: 3,4-dichloro-5-cyclopropyl-2-[4-(methylthio)benzoyl]-4-isoxazoline-3-carboxylic acid ethyl ester Formula: C17H17Cl2NO4S MolecularWeight: 402.29218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=C(ON1C(=O)C2=CC=C(C=C2)SC)C3CC3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1(C(=C(ON1C(=O)C2=CC=C(C=C2)SC)C3CC3)Cl)Cl

InChI

InChI=1S/C17H17Cl2NO4S/c1-3-23-16(22)17(19)14(18)13(10-4-5-10)24-20(17)15(21)11-6-8-12(25-2)9-7-11/h6-10H,3-5H2,1-2H3