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3-[2-(carboxymethylamino)ethanoyloxy]-5-octadecoxy-benzoic acid

3-[2-(carboxymethylamino)ethanoyloxy]-5-octadecoxy-benzoic acid

Systemtic Name:3-[2-(carboxymethylamino)ethanoyloxy]-5-octadecoxy-benzoic acid
Openeye Name:3-[2-(carboxymethylamino)acetyl]oxy-5-octadecoxy-benzoic acid
CAS Name:3-[2-(carboxymethylamino)-1-oxoethoxy]-5-octadecoxybenzoic acid
IUPAC Name:3-[2-(carboxymethylamino)acetyl]oxy-5-octadecoxybenzoic acid
Traditional Name:3-[2-(carboxymethylamino)acetyl]oxy-5-stearyloxy-benzoic acid
Formula: C29H47NO7
MolecularWeight: 521.68598
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C29H47NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-36-25-19-24(29(34)35)20-26(21-25)37-28(33)23-30-22-27(31)32/h19-21,30H,2-18,22-23H2,1H3,(H,31,32)(H,34,35)


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