[(Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-1-oxidanyl-5-oxidanylidene-4-phenyl-hex-1-en-2-yl]-triphenyl-phosphanium

Systemtic Name: [(Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-1-oxidanyl-5-oxidanylidene-4-phenyl-hex-1-en-2-yl]-triphenyl-phosphanium Openeye Name: [(1Z)-3-cyano-2-ethoxycarbonyl-1-[ethoxy(hydroxy)methylene]-4-oxo-3-phenyl-pentyl]-triphenyl-phosphonium CAS Name: [(Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-1-hydroxy-5-oxo-4-phenylhex-1-en-2-yl]-triphenylphosphonium IUPAC Name: [(Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-1-hydroxy-5-oxo-4-phenylhex-1-en-2-yl]-triphenylphosphanium Traditional Name: [(Z)-1-(1-carbethoxy-2-cyano-3-keto-2-phenyl-butyl)-2-ethoxy-2-hydroxy-vinyl]-triphenyl-phosphonium Formula: C36H35NO5P+ MolecularWeight: 592.640561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H34NO5P/c1-4-41-34(39)32(36(26-37,27(3)38)28-18-10-6-11-19-28)33(35(40)42-5-2)43(29-20-12-7-13-21-29,30-22-14-8-15-23-30)31-24-16-9-17-25-31/h6-25,32H,4-5H2,1-3H3/p+1/b35-33-