(E)-5-diphenylphosphoryl-3,6-dimethyl-oct-2-en-4-one

Systemtic Name: (E)-5-diphenylphosphoryl-3,6-dimethyl-oct-2-en-4-one Openeye Name: (E)-5-diphenylphosphoryl-3,6-dimethyl-oct-2-en-4-one CAS Name: (E)-5-diphenylphosphoryl-3,6-dimethyl-2-octen-4-one IUPAC Name: (E)-5-diphenylphosphoryl-3,6-dimethyloct-2-en-4-one Traditional Name: (E)-5-diphenylphosphoryl-3,6-dimethyl-oct-2-en-4-one Formula: C22H27O2P MolecularWeight: 354.422341

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)C(=CC)C)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)/C(=C/C)/C)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C22H27O2P/c1-5-17(3)21(23)22(18(4)6-2)25(24,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h5,7-16,18,22H,6H2,1-4H3/b17-5+