[3-(bromomethyl)phenyl] hexadecoxy (2-methylphenyl) phosphate

Systemtic Name: [3-(bromomethyl)phenyl] hexadecoxy (2-methylphenyl) phosphate Openeye Name: [3-(bromomethyl)phenyl] hexadecoxy o-tolyl phosphate CAS Name: phosphoric acid [3-(bromomethyl)phenyl] hexadecoxy (2-methylphenyl) ester IUPAC Name: [3-(bromomethyl)phenyl] hexadecoxy (2-methylphenyl) phosphate Traditional Name: phosphoric acid [3-(bromomethyl)phenyl] cetyloxy o-tolyl ester Formula: C30H46BrO5P MolecularWeight: 597.561001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOOP(=O)(OC1=CC=CC(=C1)CBr)OC2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCCCCCCCCOOP(=O)(OC1=CC=CC(=C1)CBr)OC2=CC=CC=C2C

InChI

InChI=1S/C30H46BrO5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-33-36-37(32,35-30-23-17-16-20-27(30)2)34-29-22-19-21-28(25-29)26-31/h16-17,19-23,25H,3-15,18,24,26H2,1-2H3