prop-2-enyl 6-bromanyl-3,3-dimethyl-6-(3-methyl-1-oxidanyl-2-oxidanylidene-3-phenoxy-butyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: prop-2-enyl 6-bromanyl-3,3-dimethyl-6-(3-methyl-1-oxidanyl-2-oxidanylidene-3-phenoxy-butyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: allyl 6-bromo-6-(1-hydroxy-3-methyl-2-oxo-3-phenoxy-butyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-6-(1-hydroxy-3-methyl-2-oxo-3-phenoxybutyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-bromo-6-(1-hydroxy-3-methyl-2-oxo-3-phenoxybutyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-6-(1-hydroxy-2-keto-3-methyl-3-phenoxy-butyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid allyl ester Formula: C22H26BrNO6S MolecularWeight: 512.41394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(C(C(=O)C(C)(C)OC3=CC=CC=C3)O)Br)C(=O)OCC=C)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(C(C(=O)C(C)(C)OC3=CC=CC=C3)O)Br)C(=O)OCC=C)C

InChI

InChI=1S/C22H26BrNO6S/c1-6-12-29-17(27)14-21(4,5)31-19-22(23,18(28)24(14)19)16(26)15(25)20(2,3)30-13-10-8-7-9-11-13/h6-11,14,16,19,26H,1,12H2,2-5H3