[2-(bromomethyl)phenyl] methoxy (3-tetradecoxyphenyl) phosphate

Systemtic Name: [2-(bromomethyl)phenyl] methoxy (3-tetradecoxyphenyl) phosphate Openeye Name: [2-(bromomethyl)phenyl] methoxy (3-tetradecoxyphenyl) phosphate CAS Name: phosphoric acid [2-(bromomethyl)phenyl] methoxy (3-tetradecoxyphenyl) ester IUPAC Name: [2-(bromomethyl)phenyl] methoxy (3-tetradecoxyphenyl) phosphate Traditional Name: phosphoric acid [2-(bromomethyl)phenyl] methoxy (3-myristyloxyphenyl) ester Formula: C28H42BrO6P MolecularWeight: 585.507241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=CC=C1)OP(=O)(OC2=CC=CC=C2CBr)OOC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=CC=C1)OP(=O)(OC2=CC=CC=C2CBr)OOC

InChI

InChI=1S/C28H42BrO6P/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-32-26-19-17-20-27(23-26)33-36(30,35-31-2)34-28-21-15-14-18-25(28)24-29/h14-15,17-21,23H,3-13,16,22,24H2,1-2H3