[4-[[(4-hydroxyphenyl)methoxy-(2-methoxy-2-oxidanylidene-ethyl)phosphoryl]oxymethyl]phenyl] butanoate

Systemtic Name: [4-[[(4-hydroxyphenyl)methoxy-(2-methoxy-2-oxidanylidene-ethyl)phosphoryl]oxymethyl]phenyl] butanoate Openeye Name: [4-[[(4-hydroxyphenyl)methoxy-(2-methoxy-2-oxo-ethyl)phosphoryl]oxymethyl]phenyl] butanoate CAS Name: butanoic acid [4-[[(4-hydroxyphenyl)methoxy-(2-methoxy-2-oxoethyl)phosphoryl]oxymethyl]phenyl] ester IUPAC Name: [4-[[(4-hydroxyphenyl)methoxy-(2-methoxy-2-oxoethyl)phosphoryl]oxymethyl]phenyl] butanoate Traditional Name: butyric acid [4-[[(4-hydroxybenzyl)oxy-(2-keto-2-methoxy-ethyl)phosphoryl]oxymethyl]phenyl] ester Formula: C21H25O8P MolecularWeight: 436.392161

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)COP(=O)(CC(=O)OC)OCC2=CC=C(C=C2)O

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)COP(=O)(CC(=O)OC)OCC2=CC=C(C=C2)O

InChI

InChI=1S/C21H25O8P/c1-3-4-20(23)29-19-11-7-17(8-12-19)14-28-30(25,15-21(24)26-2)27-13-16-5-9-18(22)10-6-16/h5-12,22H,3-4,13-15H2,1-2H3