O=C(COc1ccccc1)NC1C(=O)N2C(C(=O)OC(c3ccccc3)c3ccccc3)=C(OS(=O)(=O)c3ccc(Br)cc3)CS[C@H]12

Name: product

IUPAC: benzhydryl (6R)-3-(4-bromophenyl)sulfonyloxy-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

SMILES: O=C(COc1ccccc1)NC1C(=O)N2C(C(=O)OC(c3ccccc3)c3ccccc3)=C(OS(=O)(=O)c3ccc(Br)cc3)CS[C@H]12

Canonical SMILES: C1C(=C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OS(=O)(=O)C6=CC=C(C=C6)Br

Molecular formula: C34H27BrN2O8S2

Molecular weight: 735.60

InChIKey: DDVYBAKJXZDJBF-FYEOKJGGSA-N

InChI:

InChI=1S/C34H27BrN2O8S2/c35-24-16-18-26(19-17-24)47(41,42)45-27-21-46-33-29(36-28(38)20-43-25-14-8-3-9-15-25)32(39)37(33)30(27)34(40)44-31(22-10-4-1-5-11-22)23-12-6-2-7-13-23/h1-19,29,31,33H,20-21H2,(H,36,38)/t29?,33-/m1/s1

PubChem CID: 88424480 →

Synonyms

SCHEMBL9179296DDVYBAKJXZDJBF-FYEOKJGGSA-NDiphenylmethyl 7-Phenoxyacetamido-3-[(4-bromophenylsulfonyl)oxy]-3-cephem-4-carboxylate

Involved in 4 reactions→