2-[(2R,4aR,6S,7R,9Z,11aS)-7-(2,2-dimethylpropanoyloxy)-2-phenyl-4a,6,7,8,11,11a-hexahydro-4H-[1,3]dioxino[5,4-b]oxonin-6-yl]ethyl-triphenyl-phosphanium

Systemtic Name: 2-[(2R,4aR,6S,7R,9Z,11aS)-7-(2,2-dimethylpropanoyloxy)-2-phenyl-4a,6,7,8,11,11a-hexahydro-4H-[1,3]dioxino[5,4-b]oxonin-6-yl]ethyl-triphenyl-phosphanium Openeye Name: 2-[(2R,4aR,6S,7R,9Z,11aS)-7-(2,2-dimethylpropanoyloxy)-2-phenyl-4a,6,7,8,11,11a-hexahydro-4H-[1,3]dioxino[5,4-b]oxonin-6-yl]ethyl-triphenyl-phosphonium CAS Name: 2-[(2R,4aR,6S,7R,9Z,11aS)-7-(2,2-dimethyl-1-oxopropoxy)-2-phenyl-4a,6,7,8,11,11a-hexahydro-4H-[1,3]dioxino[5,4-b]oxonin-6-yl]ethyl-triphenylphosphonium IUPAC Name: 2-[(2R,4aR,6S,7R,9Z,11aS)-7-(2,2-dimethylpropanoyloxy)-2-phenyl-4a,6,7,8,11,11a-hexahydro-4H-[1,3]dioxino[5,4-b]oxonin-6-yl]ethyl-triphenylphosphanium Traditional Name: 2-[(2R,4aR,6S,7R,9Z,11aS)-2-phenyl-7-pivaloyloxy-4a,6,7,8,11,11a-hexahydro-4H-[1,3]dioxino[5,4-b]oxonin-6-yl]ethyl-triphenyl-phosphonium Formula: C41H46O5P+ MolecularWeight: 649.774701

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1CC=CCC2C(COC(O2)C3=CC=CC=C3)OC1CC[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)C(=O)O[C@@H]1C/C=C\C[C@H]2[C@@H](CO[C@H](O2)C3=CC=CC=C3)O[C@H]1CC[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C41H46O5P/c1-41(2,3)40(42)46-35-26-16-17-27-36-38(30-43-39(45-36)31-18-8-4-9-19-31)44-37(35)28-29-47(32-20-10-5-11-21-32,33-22-12-6-13-23-33)34-24-14-7-15-25-34/h4-25,35-39H,26-30H2,1-3H3/q+1/b17-16-/t35-,36+,37+,38-,39-/m1/s1