prop-2-enyl 3-[[7-(1H-imidazol-3-ium-3-ylmethyl)-9-oxidanylidene-fluoren-4-yl]oxymethyl]-4-methyl-7-oxidanylidene-6-(1-oxidanylidene-1-prop-2-enylperoxy-propan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: prop-2-enyl 3-[[7-(1H-imidazol-3-ium-3-ylmethyl)-9-oxidanylidene-fluoren-4-yl]oxymethyl]-4-methyl-7-oxidanylidene-6-(1-oxidanylidene-1-prop-2-enylperoxy-propan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: allyl 6-(2-allylperoxy-1-methyl-2-oxo-ethyl)-3-[[7-(1H-imidazol-3-ium-3-ylmethyl)-9-oxo-fluoren-4-yl]oxymethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-[[7-(1H-imidazol-3-ium-3-ylmethyl)-9-oxo-4-fluorenyl]oxymethyl]-4-methyl-7-oxo-6-(1-oxo-1-prop-2-enyldioxypropan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-[[7-(1H-imidazol-3-ium-3-ylmethyl)-9-oxofluoren-4-yl]oxymethyl]-4-methyl-7-oxo-6-(1-oxo-1-prop-2-enylperoxypropan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(2-allylperoxy-2-keto-1-methyl-ethyl)-3-[[7-(1H-imidazol-3-ium-3-ylmethyl)-9-keto-fluoren-4-yl]oxymethyl]-7-keto-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid allyl ester Formula: C35H34N3O8+ MolecularWeight: 624.65976

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C(=O)N2C(=C1COC3=CC=CC4=C3C5=C(C4=O)C=C(C=C5)C[N+]6=CNC=C6)C(=O)OCC=C)C(C)C(=O)OOCC=C

Isomeric SMILES

CC1C2C(C(=O)N2C(=C1COC3=CC=CC4=C3C5=C(C4=O)C=C(C=C5)C[N+]6=CNC=C6)C(=O)OCC=C)C(C)C(=O)OOCC=C

InChI

InChI=1S/C35H33N3O8/c1-5-14-43-35(42)31-26(20(3)30-28(33(40)38(30)31)21(4)34(41)46-45-15-6-2)18-44-27-9-7-8-24-29(27)23-11-10-22(16-25(23)32(24)39)17-37-13-12-36-19-37/h5-13,16,19-21,28,30H,1-2,14-15,17-18H2,3-4H3/p+1