(3-octadecoxy-2-phenylmethoxy-propyl) 4-chloranylbutanoate

Systemtic Name: (3-octadecoxy-2-phenylmethoxy-propyl) 4-chloranylbutanoate Openeye Name: (2-benzyloxy-3-octadecoxy-propyl) 4-chlorobutanoate CAS Name: 4-chlorobutanoic acid (3-octadecoxy-2-phenylmethoxypropyl) ester IUPAC Name: (3-octadecoxy-2-phenylmethoxypropyl) 4-chlorobutanoate Traditional Name: 4-chlorobutyric acid (2-benzoxy-3-stearyloxy-propyl) ester Formula: C32H55ClO4 MolecularWeight: 539.2297

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COC(=O)CCCCl)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COC(=O)CCCCl)OCC1=CC=CC=C1

InChI

InChI=1S/C32H55ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-26-35-28-31(29-37-32(34)24-21-25-33)36-27-30-22-18-17-19-23-30/h17-19,22-23,31H,2-16,20-21,24-29H2,1H3