8-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyl-octanamide

Systemtic Name: 8-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyl-octanamide Openeye Name: 8-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyl-octanamide CAS Name: 8-[1,2-bis(4-hydroxyphenyl)ethylthio]-N-butyl-N-methyloctanamide IUPAC Name: 8-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyloctanamide Traditional Name: 8-[1,2-bis(4-hydroxyphenyl)ethylthio]-N-butyl-N-methyl-caprylamide Formula: C27H39NO3S MolecularWeight: 457.66846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CCCCCCCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCN(C)C(=O)CCCCCCCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O

InChI

InChI=1S/C27H39NO3S/c1-3-4-19-28(2)27(31)10-8-6-5-7-9-20-32-26(23-13-17-25(30)18-14-23)21-22-11-15-24(29)16-12-22/h11-18,26,29-30H,3-10,19-21H2,1-2H3