[(E)-1-methoxy-1-oxidanylidene-oct-2-en-3-yl]-triphenyl-phosphanium

Systemtic Name: [(E)-1-methoxy-1-oxidanylidene-oct-2-en-3-yl]-triphenyl-phosphanium Openeye Name: [(1E)-1-(2-methoxy-2-oxo-ethylidene)hexyl]-triphenyl-phosphonium CAS Name: [(E)-1-methoxy-1-oxooct-2-en-3-yl]-triphenylphosphonium IUPAC Name: [(E)-1-methoxy-1-oxooct-2-en-3-yl]-triphenylphosphanium Traditional Name: [(E)-1-amyl-3-keto-3-methoxy-prop-1-enyl]-triphenyl-phosphonium Formula: C27H30O2P+ MolecularWeight: 417.499661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC(=O)OC)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCC/C(=C\C(=O)OC)/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H30O2P/c1-3-4-8-21-26(22-27(28)29-2)30(23-15-9-5-10-16-23,24-17-11-6-12-18-24)25-19-13-7-14-20-25/h5-7,9-20,22H,3-4,8,21H2,1-2H3/q+1/b26-22+