acetyloxymethyl 6-(azepan-1-ylmethylideneamino)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: acetyloxymethyl 6-(azepan-1-ylmethylideneamino)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: acetoxymethyl 6-(azepan-1-ylmethyleneamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-(1-azepanylmethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 6-(azepan-1-ylmethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-(azepan-1-ylmethyleneamino)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid acetoxymethyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)C1C(SC2N1C(=O)C2N=CN3CCCCCC3)(C)C

Isomeric SMILES

CC(=O)OCOC(=O)C1C(SC2N1C(=O)C2N=CN3CCCCCC3)(C)C

InChI

InChI=1S/C18H27N3O5S/c1-12(22)25-11-26-17(24)14-18(2,3)27-16-13(15(23)21(14)16)19-10-20-8-6-4-5-7-9-20/h10,13-14,16H,4-9,11H2,1-3H3