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5-octadecoxy-2-phenylmethoxy-benzoic acid

5-octadecoxy-2-phenylmethoxy-benzoic acid

Systemtic Name:5-octadecoxy-2-phenylmethoxy-benzoic acid
Openeye Name:2-benzyloxy-5-octadecoxy-benzoic acid
CAS Name:5-octadecoxy-2-phenylmethoxybenzoic acid
IUPAC Name:5-octadecoxy-2-phenylmethoxybenzoic acid
Traditional Name:2-benzoxy-5-stearyloxy-benzoic acid
Formula: C32H48O4
MolecularWeight: 496.72112
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCC2=CC=CC=C2)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCC2=CC=CC=C2)C(=O)O


InChI

InChI=1S/C32H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-35-29-23-24-31(30(26-29)32(33)34)36-27-28-21-18-17-19-22-28/h17-19,21-24,26H,2-16,20,25,27H2,1H3,(H,33,34)


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