(2R)-2-[(3S,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-3-yl]-3-[4-[(2S,3R)-3-[2-(4-fluoranylphenoxy)ethyl]-1-(4-fluorophenyl)-4-oxidanylidene-azetidin-2-yl]phenyl]propanoic acid

Systemtic Name: (2R)-2-[(3S,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-3-yl]-3-[4-[(2S,3R)-3-[2-(4-fluoranylphenoxy)ethyl]-1-(4-fluorophenyl)-4-oxidanylidene-azetidin-2-yl]phenyl]propanoic acid Openeye Name: (2R)-2-[(3S,4R,5R,6R)-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-3-yl]-3-[4-[(2S,3R)-3-[2-(4-fluorophenoxy)ethyl]-1-(4-fluorophenyl)-4-oxo-azetidin-2-yl]phenyl]propanoic acid CAS Name: (2R)-2-[(3S,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-oxanyl]-3-[4-[(2S,3R)-3-[2-(4-fluorophenoxy)ethyl]-1-(4-fluorophenyl)-4-oxo-2-azetidinyl]phenyl]propanoic acid IUPAC Name: (2R)-2-[(3S,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-3-yl]-3-[4-[(2S,3R)-3-[2-(4-fluorophenoxy)ethyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl]propanoic acid Traditional Name: (2R)-2-[(3S,4R,5R,6R)-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-3-yl]-3-[4-[(2S,3R)-3-[2-(4-fluorophenoxy)ethyl]-1-(4-fluorophenyl)-4-keto-azetidin-2-yl]phenyl]propionic acid Formula: C38H39F2NO11 MolecularWeight: 723.713166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(CO1)C(CC2=CC=C(C=C2)C3C(C(=O)N3C4=CC=C(C=C4)F)CCOC5=CC=C(C=C5)F)C(=O)O)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H](CO1)[C@@H](CC2=CC=C(C=C2)[C@@H]3[C@H](C(=O)N3C4=CC=C(C=C4)F)CCOC5=CC=C(C=C5)F)C(=O)O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C38H39F2NO11/c1-21(42)49-20-33-36(52-23(3)44)35(51-22(2)43)32(19-50-33)31(38(46)47)18-24-4-6-25(7-5-24)34-30(16-17-48-29-14-10-27(40)11-15-29)37(45)41(34)28-12-8-26(39)9-13-28/h4-15,30-36H,16-20H2,1-3H3,(H,46,47)/t30-,31-,32-,33-,34-,35-,36+/m1/s1