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

Systemtic Name: prop-2-enyl 6-bromanyl-6-[2-(4-methoxycarbonylphenyl)-1-oxidanyl-2-oxidanylidene-ethyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: allyl 6-bromo-6-[1-hydroxy-2-(4-methoxycarbonylphenyl)-2-oxo-ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-6-[1-hydroxy-2-(4-methoxycarbonylphenyl)-2-oxoethyl]-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-(4-methoxycarbonylphenyl)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-6-[2-(4-carbomethoxyphenyl)-1-hydroxy-2-keto-ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid allyl ester Formula: C21H22BrNO7S MolecularWeight: 512.37088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrNO7S/c1-5-10-30-17(27)14-20(2,3)31-19-21(22,18(28)23(14)19)15(25)13(24)11-6-8-12(9-7-11)16(26)29-4/h5-9,14-15,19,25H,1,10H2,2-4H3