4-(2-chloranyl-4-methylsulfinyl-phenyl)carbonyl-5-cyclopropyl-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4-(2-chloranyl-4-methylsulfinyl-phenyl)carbonyl-5-cyclopropyl-1,2-oxazole-3-carboxylic acid Openeye Name: 4-(2-chloro-4-methylsulfinyl-benzoyl)-5-cyclopropyl-isoxazole-3-carboxylic acid CAS Name: 4-[(2-chloro-4-methylsulfinylphenyl)-oxomethyl]-5-cyclopropyl-3-isoxazolecarboxylic acid IUPAC Name: 4-(2-chloro-4-methylsulfinylbenzoyl)-5-cyclopropyl-1,2-oxazole-3-carboxylic acid Traditional Name: 4-(2-chloro-4-methylsulfinyl-benzoyl)-5-cyclopropyl-isoxazole-3-carboxylic acid Formula: C15H12ClNO5S MolecularWeight: 353.77748

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC(=C(C=C1)C(=O)C2=C(ON=C2C(=O)O)C3CC3)Cl

Isomeric SMILES

CS(=O)C1=CC(=C(C=C1)C(=O)C2=C(ON=C2C(=O)O)C3CC3)Cl

InChI

InChI=1S/C15H12ClNO5S/c1-23(21)8-4-5-9(10(16)6-8)13(18)11-12(15(19)20)17-22-14(11)7-2-3-7/h4-7H,2-3H2,1H3,(H,19,20)