tert-butyl 3-(acetyloxymethyl)-7-chloranyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: tert-butyl 3-(acetyloxymethyl)-7-chloranyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: tert-butyl 3-(acetoxymethyl)-7-chloro-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(acetyloxymethyl)-7-chloro-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(acetyloxymethyl)-7-chloro-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(acetoxymethyl)-7-chloro-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester Formula: C14H20ClNO4S MolecularWeight: 333.8309

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N2CC(C2SC1)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OCC1=C(N2CC(C2SC1)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H20ClNO4S/c1-8(17)19-6-9-7-21-12-10(15)5-16(12)11(9)13(18)20-14(2,3)4/h10,12H,5-7H2,1-4H3