tert-butyl 5-methyl-7-thiabicyclo[2.2.1]hept-2-ene-5-carboxylate

Systemtic Name: tert-butyl 5-methyl-7-thiabicyclo[2.2.1]hept-2-ene-5-carboxylate Openeye Name: tert-butyl 5-methyl-7-thiabicyclo[2.2.1]hept-2-ene-5-carboxylate CAS Name: 5-methyl-7-thiabicyclo[2.2.1]hept-2-ene-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-methyl-7-thiabicyclo[2.2.1]hept-2-ene-5-carboxylate Traditional Name: 5-methyl-7-thiabicyclo[2.2.1]hept-2-ene-5-carboxylic acid tert-butyl ester Formula: C12H18O2S MolecularWeight: 226.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C=CC1S2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1(CC2C=CC1S2)C(=O)OC(C)(C)C

InChI

InChI=1S/C12H18O2S/c1-11(2,3)14-10(13)12(4)7-8-5-6-9(12)15-8/h5-6,8-9H,7H2,1-4H3