3,3-dimethyl-6-(octanoyloxymethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-6-(octanoyloxymethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3,3-dimethyl-6-(octanoyloxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-7-oxo-6-(1-oxooctoxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3,3-dimethyl-6-(octanoyloxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-(caprylyloxymethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H27NO5S MolecularWeight: 357.46498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC1C2N(C1=O)C(C(S2)(C)C)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)OCC1C2N(C1=O)C(C(S2)(C)C)C(=O)O

InChI

InChI=1S/C17H27NO5S/c1-4-5-6-7-8-9-12(19)23-10-11-14(20)18-13(16(21)22)17(2,3)24-15(11)18/h11,13,15H,4-10H2,1-3H3,(H,21,22)