methyl 2-(3-cyclopropyl-3-oxidanylidene-propanoyl)-5-(trifluoromethyl)benzenesulfinate

Systemtic Name: methyl 2-(3-cyclopropyl-3-oxidanylidene-propanoyl)-5-(trifluoromethyl)benzenesulfinate Openeye Name: methyl 2-(3-cyclopropyl-3-oxo-propanoyl)-5-(trifluoromethyl)benzenesulfinate CAS Name: 2-(3-cyclopropyl-1,3-dioxopropyl)-5-(trifluoromethyl)benzenesulfinic acid methyl ester IUPAC Name: methyl 2-(3-cyclopropyl-3-oxopropanoyl)-5-(trifluoromethyl)benzenesulfinate Traditional Name: 2-(3-cyclopropyl-3-keto-propanoyl)-5-(trifluoromethyl)benzenesulfinic acid methyl ester Formula: C14H13F3O4S MolecularWeight: 334.31083

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)CC(=O)C2CC2

Isomeric SMILES

COS(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)CC(=O)C2CC2

InChI

InChI=1S/C14H13F3O4S/c1-21-22(20)13-6-9(14(15,16)17)4-5-10(13)12(19)7-11(18)8-2-3-8/h4-6,8H,2-3,7H2,1H3