4-[3,4-bis(chloranyl)-2-methylsulfanyl-phenyl]carbonyl-5-cyclopropyl-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4-[3,4-bis(chloranyl)-2-methylsulfanyl-phenyl]carbonyl-5-cyclopropyl-1,2-oxazole-3-carboxylic acid Openeye Name: 5-cyclopropyl-4-(3,4-dichloro-2-methylsulfanyl-benzoyl)isoxazole-3-carboxylic acid CAS Name: 5-cyclopropyl-4-[[3,4-dichloro-2-(methylthio)phenyl]-oxomethyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-cyclopropyl-4-(3,4-dichloro-2-methylsulfanylbenzoyl)-1,2-oxazole-3-carboxylic acid Traditional Name: 5-cyclopropyl-4-[3,4-dichloro-2-(methylthio)benzoyl]isoxazole-3-carboxylic acid Formula: C15H11Cl2NO4S MolecularWeight: 372.22314

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1Cl)Cl)C(=O)C2=C(ON=C2C(=O)O)C3CC3

Isomeric SMILES

CSC1=C(C=CC(=C1Cl)Cl)C(=O)C2=C(ON=C2C(=O)O)C3CC3

InChI

InChI=1S/C15H11Cl2NO4S/c1-23-14-7(4-5-8(16)10(14)17)12(19)9-11(15(20)21)18-22-13(9)6-2-3-6/h4-6H,2-3H2,1H3,(H,20,21)