[3-(bromomethyl)phenyl] [2-methoxy-3-(4-tetradecylphenoxy)propyl] hydrogen phosphate

Systemtic Name: [3-(bromomethyl)phenyl] [2-methoxy-3-(4-tetradecylphenoxy)propyl] hydrogen phosphate Openeye Name: [3-(bromomethyl)phenyl] [2-methoxy-3-(4-tetradecylphenoxy)propyl] hydrogen phosphate CAS Name: [3-(bromomethyl)phenyl] [2-methoxy-3-(4-tetradecylphenoxy)propyl] hydrogen phosphate IUPAC Name: [3-(bromomethyl)phenyl] [2-methoxy-3-(4-tetradecylphenoxy)propyl] hydrogen phosphate Traditional Name: [3-(bromomethyl)phenyl] [2-methoxy-3-(4-myristylphenoxy)propyl] hydrogen phosphate Formula: C31H48BrO6P MolecularWeight: 627.586981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(=O)(O)OC2=CC=CC(=C2)CBr)OC

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(=O)(O)OC2=CC=CC(=C2)CBr)OC

InChI

InChI=1S/C31H48BrO6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-27-19-21-29(22-20-27)36-25-31(35-2)26-37-39(33,34)38-30-18-15-17-28(23-30)24-32/h15,17-23,31H,3-14,16,24-26H2,1-2H3,(H,33,34)