octyl phenyl (phenylmethyl) phosphate

Systemtic Name: octyl phenyl (phenylmethyl) phosphate Openeye Name: benzyl octyl phenyl phosphate CAS Name: phosphoric acid octyl phenyl (phenylmethyl) ester IUPAC Name: benzyl octyl phenyl phosphate Traditional Name: phosphoric acid benzyl octyl phenyl ester Formula: C21H29O4P MolecularWeight: 376.426321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(OCC1=CC=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCOP(=O)(OCC1=CC=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H29O4P/c1-2-3-4-5-6-13-18-23-26(22,25-21-16-11-8-12-17-21)24-19-20-14-9-7-10-15-20/h7-12,14-17H,2-6,13,18-19H2,1H3