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6-octadecoxy-1-oxidanyl-naphthalene-2-carboxylic acid

6-octadecoxy-1-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name:6-octadecoxy-1-oxidanyl-naphthalene-2-carboxylic acid
Openeye Name:1-hydroxy-6-octadecoxy-naphthalene-2-carboxylic acid
CAS Name:1-hydroxy-6-octadecoxy-2-naphthalenecarboxylic acid
IUPAC Name:1-hydroxy-6-octadecoxynaphthalene-2-carboxylic acid
Traditional Name:1-hydroxy-6-stearyloxy-2-naphthoic acid
Formula: C29H44O4
MolecularWeight: 456.65726
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC2=C(C=C1)C(=C(C=C2)C(=O)O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC2=C(C=C1)C(=C(C=C2)C(=O)O)O


InChI

InChI=1S/C29H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-33-25-19-21-26-24(23-25)18-20-27(28(26)30)29(31)32/h18-21,23,30H,2-17,22H2,1H3,(H,31,32)


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