N-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-11-(2-hexyl-3-oxidanyl-phenoxy)undecanamide

Systemtic Name: N-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-11-(2-hexyl-3-oxidanyl-phenoxy)undecanamide Openeye Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-11-(2-hexyl-3-hydroxy-phenoxy)undecanamide CAS Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-11-(2-hexyl-3-hydroxyphenoxy)undecanamide IUPAC Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-11-(2-hexyl-3-hydroxyphenoxy)undecanamide Traditional Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-11-(2-hexyl-3-hydroxy-phenoxy)undecanamide Formula: C31H47NO5 MolecularWeight: 513.70858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC=C1OCCCCCCCCCCC(=O)NCCC2=CC(=C(C=C2)O)O)O

Isomeric SMILES

CCCCCCC1=C(C=CC=C1OCCCCCCCCCCC(=O)NCCC2=CC(=C(C=C2)O)O)O

InChI

InChI=1S/C31H47NO5/c1-2-3-4-11-15-26-27(33)16-14-17-30(26)37-23-13-10-8-6-5-7-9-12-18-31(36)32-22-21-25-19-20-28(34)29(35)24-25/h14,16-17,19-20,24,33-35H,2-13,15,18,21-23H2,1H3,(H,32,36)