[6-[[2-(4-acetyloxyphenyl)-2-azido-ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptan-2-yl]carbonyloxymethyl 6-(1-azanyl-2-oxidanylidene-2-phenylmethoxy-ethyl)-3,3-dimethyl-4,4,7-tris(oxidanylidene)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: [6-[[2-(4-acetyloxyphenyl)-2-azido-ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptan-2-yl]carbonyloxymethyl 6-(1-azanyl-2-oxidanylidene-2-phenylmethoxy-ethyl)-3,3-dimethyl-4,4,7-tris(oxidanylidene)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: [6-[[2-(4-acetoxyphenyl)-2-azido-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxymethyl 6-(1-amino-2-benzyloxy-2-oxo-ethyl)-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-(1-amino-2-oxo-2-phenylmethoxyethyl)-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid [[6-[[2-(4-acetyloxyphenyl)-2-azido-1-oxoethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-2-yl]-oxomethoxy]methyl ester IUPAC Name: [6-[[2-(4-acetyloxyphenyl)-2-azidoacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxymethyl 6-(1-amino-2-oxo-2-phenylmethoxyethyl)-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-(1-amino-2-benzoxy-2-keto-ethyl)-4,4,7-triketo-3,3-dimethyl-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid [6-[[2-(4-acetoxyphenyl)-2-azido-acetyl]amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxymethyl ester Formula: C36H39N7O13S2 MolecularWeight: 841.86396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(C(=O)NC2C3N(C2=O)C(C(S3)(C)C)C(=O)OCOC(=O)C4C(S(=O)(=O)C5N4C(=O)C5C(C(=O)OCC6=CC=CC=C6)N)(C)C)N=[N+]=[N-]

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C(C(=O)NC2C3N(C2=O)C(C(S3)(C)C)C(=O)OCOC(=O)C4C(S(=O)(=O)C5N4C(=O)C5C(C(=O)OCC6=CC=CC=C6)N)(C)C)N=[N+]=[N-]

InChI

InChI=1S/C36H39N7O13S2/c1-17(44)56-20-13-11-19(12-14-20)23(40-41-38)27(45)39-24-29(47)42-25(35(2,3)57-30(24)42)33(49)54-16-55-34(50)26-36(4,5)58(51,52)31-21(28(46)43(26)31)22(37)32(48)53-15-18-9-7-6-8-10-18/h6-14,21-26,30-31H,15-16,37H2,1-5H3,(H,39,45)