[(Z)-4-cyano-1-oxidanyl-5-oxidanylidene-4-phenyl-1-propan-2-yloxy-3-propan-2-yloxycarbonyl-hept-1-en-2-yl]-triphenyl-phosphanium

Systemtic Name: [(Z)-4-cyano-1-oxidanyl-5-oxidanylidene-4-phenyl-1-propan-2-yloxy-3-propan-2-yloxycarbonyl-hept-1-en-2-yl]-triphenyl-phosphanium Openeye Name: [(1Z)-3-cyano-1-[hydroxy(isopropoxy)methylene]-2-isopropoxycarbonyl-4-oxo-3-phenyl-hexyl]-triphenyl-phosphonium CAS Name: [(Z)-4-cyano-1-hydroxy-5-oxo-3-[oxo(propan-2-yloxy)methyl]-4-phenyl-1-propan-2-yloxyhept-1-en-2-yl]-triphenylphosphonium IUPAC Name: [(Z)-4-cyano-1-hydroxy-5-oxo-4-phenyl-1-propan-2-yloxy-3-propan-2-yloxycarbonylhept-1-en-2-yl]-triphenylphosphanium Traditional Name: [(Z)-1-(2-cyano-1-isopropoxycarbonyl-3-keto-2-phenyl-pentyl)-2-hydroxy-2-isopropoxy-vinyl]-triphenyl-phosphonium Formula: C39H41NO5P+ MolecularWeight: 634.720301

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C#N)(C1=CC=CC=C1)C(C(=C(O)OC(C)C)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC(C)C

Isomeric SMILES

CCC(=O)C(C#N)(C1=CC=CC=C1)C(/C(=C(\O)/OC(C)C)/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC(C)C

InChI

InChI=1S/C39H40NO5P/c1-6-34(41)39(27-40,30-19-11-7-12-20-30)35(37(42)44-28(2)3)36(38(43)45-29(4)5)46(31-21-13-8-14-22-31,32-23-15-9-16-24-32)33-25-17-10-18-26-33/h7-26,28-29,35H,6H2,1-5H3/p+1/b38-36-