ethyl 5-tert-butyl-2-chloranylsulfonyl-cyclohexene-1-carboxylate

Systemtic Name: ethyl 5-tert-butyl-2-chloranylsulfonyl-cyclohexene-1-carboxylate Openeye Name: ethyl 5-tert-butyl-2-chlorosulfonyl-cyclohexene-1-carboxylate CAS Name: 5-tert-butyl-2-chlorosulfonyl-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-tert-butyl-2-chlorosulfonylcyclohexene-1-carboxylate Traditional Name: 5-tert-butyl-2-chlorosulfonyl-cyclohexene-1-carboxylic acid ethyl ester Formula: C13H21ClO4S MolecularWeight: 308.82144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(CCC(C1)C(C)(C)C)S(=O)(=O)Cl

Isomeric SMILES

CCOC(=O)C1=C(CCC(C1)C(C)(C)C)S(=O)(=O)Cl

InChI

InChI=1S/C13H21ClO4S/c1-5-18-12(15)10-8-9(13(2,3)4)6-7-11(10)19(14,16)17/h9H,5-8H2,1-4H3