(4-phenylmethoxyphenyl) 2-(2-oxidanylidene-1,3,2-oxazaphosphocan-2-ium-3-yl)ethanoate

Systemtic Name: (4-phenylmethoxyphenyl) 2-(2-oxidanylidene-1,3,2-oxazaphosphocan-2-ium-3-yl)ethanoate Openeye Name: (4-benzyloxyphenyl) 2-(2-oxo-1,3,2-oxazaphosphocan-2-ium-3-yl)acetate CAS Name: 2-(2-oxo-1,3,2-oxazaphosphocan-2-ium-3-yl)acetic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 2-(2-oxo-1,3,2-oxazaphosphocan-2-ium-3-yl)acetate Traditional Name: 2-(2-keto-1,3,2-oxazaphosphocan-2-ium-3-yl)acetic acid (4-benzoxyphenyl) ester Formula: C20H23NO5P+ MolecularWeight: 388.374081

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN([P+](=O)OCC1)CC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CCN([P+](=O)OCC1)CC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H23NO5P/c22-20(15-21-13-5-2-6-14-25-27(21)23)26-19-11-9-18(10-12-19)24-16-17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-16H2/q+1