tert-butyl (1S,2S,3R)-4,4-bis(chloranyl)-2-ethoxycarbothioyl-3-methyl-cyclopentane-1-carboxylate

Systemtic Name: tert-butyl (1S,2S,3R)-4,4-bis(chloranyl)-2-ethoxycarbothioyl-3-methyl-cyclopentane-1-carboxylate Openeye Name: tert-butyl (1S,2S,3R)-4,4-dichloro-2-ethoxycarbothioyl-3-methyl-cyclopentanecarboxylate CAS Name: (1S,2S,3R)-4,4-dichloro-2-[ethoxy(sulfanylidene)methyl]-3-methyl-1-cyclopentanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,2S,3R)-4,4-dichloro-2-ethoxycarbothioyl-3-methylcyclopentane-1-carboxylate Traditional Name: (1S,2S,3R)-4,4-dichloro-2-ethoxycarbothioyl-3-methyl-cyclopentanecarboxylic acid tert-butyl ester Formula: C14H22Cl2O3S MolecularWeight: 341.29368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)C1C(C(CC1C(=O)OC(C)(C)C)(Cl)Cl)C

Isomeric SMILES

CCOC(=S)[C@@H]1[C@H](C(C[C@@H]1C(=O)OC(C)(C)C)(Cl)Cl)C

InChI

InChI=1S/C14H22Cl2O3S/c1-6-18-12(20)10-8(2)14(15,16)7-9(10)11(17)19-13(3,4)5/h8-10H,6-7H2,1-5H3/t8-,9+,10-/m1/s1