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

Systemtic Name: [4-[[(4-butanoyloxyphenyl)methoxy-(2-methoxy-2-oxidanylidene-ethyl)phosphoryl]oxymethyl]phenyl] butanoate Openeye Name: [4-[[(4-butanoyloxyphenyl)methoxy-(2-methoxy-2-oxo-ethyl)phosphoryl]oxymethyl]phenyl] butanoate CAS Name: butanoic acid [4-[[(2-methoxy-2-oxoethyl)-[[4-(1-oxobutoxy)phenyl]methoxy]phosphoryl]oxymethyl]phenyl] ester IUPAC Name: [4-[[(4-butanoyloxyphenyl)methoxy-(2-methoxy-2-oxoethyl)phosphoryl]oxymethyl]phenyl] butanoate Traditional Name: butyric acid [4-[[(4-butyryloxybenzyl)oxy-(2-keto-2-methoxy-ethyl)phosphoryl]oxymethyl]phenyl] ester Formula: C25H31O9P MolecularWeight: 506.482001

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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)OC(=O)CCC

Isomeric SMILES

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

InChI

InChI=1S/C25H31O9P/c1-4-6-23(26)33-21-12-8-19(9-13-21)16-31-35(29,18-25(28)30-3)32-17-20-10-14-22(15-11-20)34-24(27)7-5-2/h8-15H,4-7,16-18H2,1-3H3