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3-octadecoxy-5-(3-phenoxypropoxy)benzoic acid

3-octadecoxy-5-(3-phenoxypropoxy)benzoic acid

Systemtic Name:3-octadecoxy-5-(3-phenoxypropoxy)benzoic acid
Openeye Name:3-octadecoxy-5-(3-phenoxypropoxy)benzoic acid
CAS Name:3-octadecoxy-5-(3-phenoxypropoxy)benzoic acid
IUPAC Name:3-octadecoxy-5-(3-phenoxypropoxy)benzoic acid
Traditional Name:3-(3-phenoxypropoxy)-5-stearyloxy-benzoic acid
Formula: C34H52O5
MolecularWeight: 540.77368
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OCCCOC2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OCCCOC2=CC=CC=C2


InChI

InChI=1S/C34H52O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-38-32-27-30(34(35)36)28-33(29-32)39-26-21-25-37-31-22-18-17-19-23-31/h17-19,22-23,27-29H,2-16,20-21,24-26H2,1H3,(H,35,36)


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