[(3R,4E)-8-chloranyl-2,4-dimethyl-octa-1,4-dien-3-yl] 2-diphenylphosphanylbenzoate

Systemtic Name: [(3R,4E)-8-chloranyl-2,4-dimethyl-octa-1,4-dien-3-yl] 2-diphenylphosphanylbenzoate Openeye Name: [(E,1R)-6-chloro-1-isopropenyl-2-methyl-hex-2-enyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid [(3R,4E)-8-chloro-2,4-dimethylocta-1,4-dien-3-yl] ester IUPAC Name: [(3R,4E)-8-chloro-2,4-dimethylocta-1,4-dien-3-yl] 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [(E,1R)-6-chloro-1-isopropenyl-2-methyl-hex-2-enyl] ester Formula: C29H30ClO2P MolecularWeight: 476.974061

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=CCCCCl)C)OC(=O)C1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=C)[C@H](/C(=C/CCCCl)/C)OC(=O)C1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C29H30ClO2P/c1-22(2)28(23(3)14-12-13-21-30)32-29(31)26-19-10-11-20-27(26)33(24-15-6-4-7-16-24)25-17-8-5-9-18-25/h4-11,14-20,28H,1,12-13,21H2,2-3H3/b23-14+/t28-/m1/s1