[(E)-4-diphenylphosphoryl-2,2-dimethyl-3-oxidanyl-5-phenyl-pent-4-enyl] 4-methoxybenzoate

Systemtic Name: [(E)-4-diphenylphosphoryl-2,2-dimethyl-3-oxidanyl-5-phenyl-pent-4-enyl] 4-methoxybenzoate Openeye Name: [(E)-4-diphenylphosphoryl-3-hydroxy-2,2-dimethyl-5-phenyl-pent-4-enyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(E)-4-diphenylphosphoryl-3-hydroxy-2,2-dimethyl-5-phenylpent-4-enyl] ester IUPAC Name: [(E)-4-diphenylphosphoryl-3-hydroxy-2,2-dimethyl-5-phenylpent-4-enyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(E)-4-diphenylphosphoryl-3-hydroxy-2,2-dimethyl-5-phenyl-pent-4-enyl] ester Formula: C33H33O5P MolecularWeight: 540.585881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CC=C(C=C1)OC)C(C(=CC2=CC=CC=C2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(COC(=O)C1=CC=C(C=C1)OC)C(/C(=C\C2=CC=CC=C2)/P(=O)(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C33H33O5P/c1-33(2,24-38-32(35)26-19-21-27(37-3)22-20-26)31(34)30(23-25-13-7-4-8-14-25)39(36,28-15-9-5-10-16-28)29-17-11-6-12-18-29/h4-23,31,34H,24H2,1-3H3/b30-23+