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3-(5-methoxy-5-oxidanylidene-pentoxy)-5-octadecoxy-benzoic acid

3-(5-methoxy-5-oxidanylidene-pentoxy)-5-octadecoxy-benzoic acid

Systemtic Name:3-(5-methoxy-5-oxidanylidene-pentoxy)-5-octadecoxy-benzoic acid
Openeye Name:3-(5-methoxy-5-oxo-pentoxy)-5-octadecoxy-benzoic acid
CAS Name:3-(5-methoxy-5-oxopentoxy)-5-octadecoxybenzoic acid
IUPAC Name:3-(5-methoxy-5-oxopentoxy)-5-octadecoxybenzoic acid
Traditional Name:3-(5-keto-5-methoxy-pentoxy)-5-stearyloxy-benzoic acid
Formula: C31H52O6
MolecularWeight: 520.74098
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)OCCCCC(=O)OC)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)OCCCCC(=O)OC)C(=O)O


InChI

InChI=1S/C31H52O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-36-28-24-27(31(33)34)25-29(26-28)37-23-20-18-21-30(32)35-2/h24-26H,3-23H2,1-2H3,(H,33,34)


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