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

Systemtic Name: [(2R,3R)-3-diphenylphosphoryl-1-[methoxy(methyl)amino]-1-oxidanylidene-heptan-2-yl] benzoate Openeye Name: [(1R,2R)-2-diphenylphosphoryl-1-[methoxy(methyl)carbamoyl]hexyl] benzoate CAS Name: benzoic acid [(2R,3R)-3-diphenylphosphoryl-1-[methoxy(methyl)amino]-1-oxoheptan-2-yl] ester IUPAC Name: [(2R,3R)-3-diphenylphosphoryl-1-[methoxy(methyl)amino]-1-oxoheptan-2-yl] benzoate Traditional Name: benzoic acid [(1R,2R)-2-diphenylphosphoryl-1-[methoxy(methyl)carbamoyl]hexyl] ester Formula: C28H32NO5P MolecularWeight: 493.531141

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C28H32NO5P/c1-4-5-21-25(35(32,23-17-11-7-12-18-23)24-19-13-8-14-20-24)26(27(30)29(2)33-3)34-28(31)22-15-9-6-10-16-22/h6-20,25-26H,4-5,21H2,1-3H3/t25-,26+/m1/s1