[1-(4-phenylmethoxyphenoxy)-3-phosphonooxy-propan-2-yl] ethanoate

Systemtic Name: [1-(4-phenylmethoxyphenoxy)-3-phosphonooxy-propan-2-yl] ethanoate Openeye Name: [1-[(4-benzyloxyphenoxy)methyl]-2-phosphonooxy-ethyl] acetate CAS Name: acetic acid [1-(4-phenylmethoxyphenoxy)-3-phosphonooxypropan-2-yl] ester IUPAC Name: [1-(4-phenylmethoxyphenoxy)-3-phosphonooxypropan-2-yl] acetate Traditional Name: acetic acid [1-[(4-benzoxyphenoxy)methyl]-2-phosphonooxy-ethyl] ester Formula: C18H21O8P MolecularWeight: 396.328301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(COC1=CC=C(C=C1)OCC2=CC=CC=C2)COP(=O)(O)O

Isomeric SMILES

CC(=O)OC(COC1=CC=C(C=C1)OCC2=CC=CC=C2)COP(=O)(O)O

InChI

InChI=1S/C18H21O8P/c1-14(19)26-18(13-25-27(20,21)22)12-24-17-9-7-16(8-10-17)23-11-15-5-3-2-4-6-15/h2-10,18H,11-13H2,1H3,(H2,20,21,22)