prop-2-enyl 6-bromanyl-3,3-dimethyl-7-oxidanylidene-6-(1-oxidanyl-2-oxidanylidene-2-thiophen-3-yl-ethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: prop-2-enyl 6-bromanyl-3,3-dimethyl-7-oxidanylidene-6-(1-oxidanyl-2-oxidanylidene-2-thiophen-3-yl-ethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: allyl 6-bromo-6-[1-hydroxy-2-oxo-2-(3-thienyl)ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-6-[1-hydroxy-2-oxo-2-(3-thiophenyl)ethyl]-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-2-oxo-2-thiophen-3-ylethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-6-[1-hydroxy-2-keto-2-(3-thienyl)ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid allyl ester Formula: C17H18BrNO5S2 MolecularWeight: 460.36252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrNO5S2/c1-4-6-24-13(22)11-16(2,3)26-15-17(18,14(23)19(11)15)12(21)10(20)9-5-7-25-8-9/h4-5,7-8,11-12,15,21H,1,6H2,2-3H3