(3-methyl-1-phenyl-but-3-enyl) 2-diphenylphosphanylbenzoate

Systemtic Name: (3-methyl-1-phenyl-but-3-enyl) 2-diphenylphosphanylbenzoate Openeye Name: (3-methyl-1-phenyl-but-3-enyl) 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid (3-methyl-1-phenylbut-3-enyl) ester IUPAC Name: (3-methyl-1-phenylbut-3-enyl) 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid (3-methyl-1-phenyl-but-3-enyl) ester Formula: C30H27O2P MolecularWeight: 450.507941

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=C)CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H27O2P/c1-23(2)22-28(24-14-6-3-7-15-24)32-30(31)27-20-12-13-21-29(27)33(25-16-8-4-9-17-25)26-18-10-5-11-19-26/h3-21,28H,1,22H2,2H3