[(1S,2R)-2-hexadecoxy-1-[(3-nitrophenyl)sulfonyloxymethyl]cyclopentyl] (2R)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate

Systemtic Name: [(1S,2R)-2-hexadecoxy-1-[(3-nitrophenyl)sulfonyloxymethyl]cyclopentyl] (2R)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate Openeye Name: [(1S,2R)-2-hexadecoxy-1-[(3-nitrophenyl)sulfonyloxymethyl]cyclopentyl] (2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate CAS Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(1S,2R)-2-hexadecoxy-1-[(3-nitrophenyl)sulfonyloxymethyl]cyclopentyl] ester IUPAC Name: [(1S,2R)-2-hexadecoxy-1-[(3-nitrophenyl)sulfonyloxymethyl]cyclopentyl] (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate Traditional Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propionic acid [(1S,2R)-2-cetyloxy-1-[(3-nitrophenyl)sulfonyloxymethyl]cyclopentyl] ester Formula: C38H54F3NO9S MolecularWeight: 757.89687

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1CCCC1(COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])OC(=O)C(C3=CC=CC=C3)(C(F)(F)F)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCO[C@@H]1CCC[C@@]1(COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])OC(=O)[C@](C3=CC=CC=C3)(C(F)(F)F)OC

InChI

InChI=1S/C38H54F3NO9S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-28-49-34-26-21-27-36(34,30-50-52(46,47)33-25-20-24-32(29-33)42(44)45)51-35(43)37(48-2,38(39,40)41)31-22-17-16-18-23-31/h16-18,20,22-25,29,34H,3-15,19,21,26-28,30H2,1-2H3/t34-,36+,37-/m1/s1