(phenylmethyl) 3,3-dimethyl-7-oxidanylidene-6-(1-oxidanyl-2-oxidanylidene-2-prop-2-enoxy-ethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 3,3-dimethyl-7-oxidanylidene-6-(1-oxidanyl-2-oxidanylidene-2-prop-2-enoxy-ethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 6-(2-allyloxy-1-hydroxy-2-oxo-ethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-(1-hydroxy-2-oxo-2-prop-2-enoxyethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(1-hydroxy-2-oxo-2-prop-2-enoxyethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-(2-allyloxy-1-hydroxy-2-keto-ethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C(=O)OCC=C)O)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C(=O)OCC=C)O)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C20H23NO6S/c1-4-10-26-18(24)14(22)13-16(23)21-15(20(2,3)28-17(13)21)19(25)27-11-12-8-6-5-7-9-12/h4-9,13-15,17,22H,1,10-11H2,2-3H3