[(2S,3R)-3-diphenylphosphoryl-1-methoxy-1-oxidanylidene-heptan-2-yl] benzoate

Systemtic Name: [(2S,3R)-3-diphenylphosphoryl-1-methoxy-1-oxidanylidene-heptan-2-yl] benzoate Openeye Name: [(1S,2R)-2-diphenylphosphoryl-1-methoxycarbonyl-hexyl] benzoate CAS Name: benzoic acid [(2S,3R)-3-diphenylphosphoryl-1-methoxy-1-oxoheptan-2-yl] ester IUPAC Name: [(2S,3R)-3-diphenylphosphoryl-1-methoxy-1-oxoheptan-2-yl] benzoate Traditional Name: benzoic acid [(1S,2R)-1-carbomethoxy-2-diphenylphosphoryl-hexyl] ester Formula: C27H29O5P MolecularWeight: 464.489921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)OC)OC(=O)C1=CC=CC=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC[C@H]([C@H](C(=O)OC)OC(=O)C1=CC=CC=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29O5P/c1-3-4-20-24(25(27(29)31-2)32-26(28)21-14-8-5-9-15-21)33(30,22-16-10-6-11-17-22)23-18-12-7-13-19-23/h5-19,24-25H,3-4,20H2,1-2H3/t24-,25-/m1/s1