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3-[(4-octadecoxyphenyl)methyl]-2-oxidanyl-benzoic acid

3-[(4-octadecoxyphenyl)methyl]-2-oxidanyl-benzoic acid

Systemtic Name:3-[(4-octadecoxyphenyl)methyl]-2-oxidanyl-benzoic acid
Openeye Name:2-hydroxy-3-[(4-octadecoxyphenyl)methyl]benzoic acid
CAS Name:2-hydroxy-3-[(4-octadecoxyphenyl)methyl]benzoic acid
IUPAC Name:2-hydroxy-3-[(4-octadecoxyphenyl)methyl]benzoic acid
Traditional Name:2-hydroxy-3-(4-stearyloxybenzyl)benzoic acid
Formula: C32H48O4
MolecularWeight: 496.72112
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)CC2=CC=CC(=C2O)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)CC2=CC=CC(=C2O)C(=O)O


InChI

InChI=1S/C32H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-36-29-23-21-27(22-24-29)26-28-19-18-20-30(31(28)33)32(34)35/h18-24,33H,2-17,25-26H2,1H3,(H,34,35)


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