(4-methoxyphenyl)methyl 3-ethylsulfonyloxy-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 3-ethylsulfonyloxy-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 3-ethylsulfonyloxy-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-ethylsulfonyloxy-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 3-ethylsulfonyloxy-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-esyloxy-8-keto-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid p-anisyl ester Formula: C25H26N2O9S2 MolecularWeight: 562.61194

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)SC1)C(=O)OCC4=CC=C(C=C4)OC

Isomeric SMILES

CCS(=O)(=O)OC1=C(N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)SC1)C(=O)OCC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H26N2O9S2/c1-3-38(31,32)36-19-15-37-24-21(26-20(28)14-34-18-7-5-4-6-8-18)23(29)27(24)22(19)25(30)35-13-16-9-11-17(33-2)12-10-16/h4-12,21,24H,3,13-15H2,1-2H3,(H,26,28)