prop-2-enyl (5R,6S)-3-ethylsulfinyl-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: prop-2-enyl (5R,6S)-3-ethylsulfinyl-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: allyl (5R,6S)-3-ethylsulfinyl-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: (5R,6S)-3-ethylsulfinyl-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (5R,6S)-3-ethylsulfinyl-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: (5R,6S)-3-ethylsulfinyl-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid allyl ester Formula: C13H17NO5S2 MolecularWeight: 331.40778

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=C(N2C(S1)C(C2=O)C(C)O)C(=O)OCC=C

Isomeric SMILES

CCS(=O)C1=C(N2[C@H](S1)[C@H](C2=O)C(C)O)C(=O)OCC=C

InChI

InChI=1S/C13H17NO5S2/c1-4-6-19-12(17)9-13(21(18)5-2)20-11-8(7(3)15)10(16)14(9)11/h4,7-8,11,15H,1,5-6H2,2-3H3/t7?,8-,11+,21?/m0/s1