3-[1-(carboxymethyloxy)ethyl]-3-oxidanyl-nonadec-4-ynoic acid

Systemtic Name: 3-[1-(carboxymethyloxy)ethyl]-3-oxidanyl-nonadec-4-ynoic acid Openeye Name: 3-[1-(carboxymethyloxy)ethyl]-3-hydroxy-nonadec-4-ynoic acid CAS Name: 3-[1-(carboxymethyloxy)ethyl]-3-hydroxy-4-nonadecynoic acid IUPAC Name: 3-[1-(carboxymethyloxy)ethyl]-3-hydroxynonadec-4-ynoic acid Traditional Name: 3-[1-(carboxymethyloxy)ethyl]-3-hydroxy-nonadec-4-ynoic acid Formula: C23H40O6 MolecularWeight: 412.5601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC#CC(CC(=O)O)(C(C)OCC(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCC#CC(CC(=O)O)(C(C)OCC(=O)O)O

InChI

InChI=1S/C23H40O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28,18-21(24)25)20(2)29-19-22(26)27/h20,28H,3-15,18-19H2,1-2H3,(H,24,25)(H,26,27)