(diphenylmethyl) (6R,7R)-3-[[2-[2,4-bis(chloranyl)phenoxy]-5-chloranyl-phenoxy]carbonyloxymethyl]-5,8-bis(oxidanylidene)-7-(2-thiophen-2-ylethanoylamino)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (6R,7R)-3-[[2-[2,4-bis(chloranyl)phenoxy]-5-chloranyl-phenoxy]carbonyloxymethyl]-5,8-bis(oxidanylidene)-7-(2-thiophen-2-ylethanoylamino)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl (6R,7R)-3-[[5-chloro-2-(2,4-dichlorophenoxy)phenoxy]carbonyloxymethyl]-5,8-dioxo-7-[[2-(2-thienyl)acetyl]amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6R,7R)-3-[[[5-chloro-2-(2,4-dichlorophenoxy)phenoxy]-oxomethoxy]methyl]-5,8-dioxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (6R,7R)-3-[[5-chloro-2-(2,4-dichlorophenoxy)phenoxy]carbonyloxymethyl]-5,8-dioxo-7-[(2-thiophen-2-ylacetyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6R,7R)-3-[[5-chloro-2-(2,4-dichlorophenoxy)phenoxy]carbonyloxymethyl]-5,8-diketo-7-[[2-(2-thienyl)acetyl]amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C40H29Cl3N2O9S2 MolecularWeight: 852.15526

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1=O)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)COC(=O)OC6=C(C=CC(=C6)Cl)OC7=C(C=C(C=C7)Cl)Cl

Isomeric SMILES

C1C(=C(N2[C@H](S1=O)[C@@H](C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)COC(=O)OC6=C(C=CC(=C6)Cl)OC7=C(C=C(C=C7)Cl)Cl

InChI

InChI=1S/C40H29Cl3N2O9S2/c41-26-13-15-30(29(43)18-26)52-31-16-14-27(42)19-32(31)53-40(49)51-21-25-22-56(50)38-34(44-33(46)20-28-12-7-17-55-28)37(47)45(38)35(25)39(48)54-36(23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-19,34,36,38H,20-22H2,(H,44,46)/t34-,38-,56?/m1/s1