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Reference substances

Reference substances

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General information

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Reference substance information

IUPAC name:
1-(4-{2-[4-( C18 unsat rich alcanoyl)piperazin-1-yl]ethyl}piperazin-1-yl)-C18 unsat Rich alcan-1-one
Synonyms
Names:
Identifier:
IUPAC name
(10E,10'E)-1,1'-[ethane-1,2-diyldi(piperazine-4,1-diyl)]di(octadec-10-en-1-one)

Molecular and structural information

Molecular formula:
C12H20N4O2; R1 R2 as fatty acid chain

Molecular weight:
>= 673 - <= 732
SMILES notation:
design arbitrary R1 = R2 = C17H33
InChI=1S/C46H86N4O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-45(51)49-41-37-47(38-42-49)35-36-48-39-43-50(44-40-48)46(52)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15-18H,3-14,19-44H2,1-2H3/b17-15+,18-16+
InChl:
design arbitrary R1 = R2 = C17H33
InChI=1S/C46H86N4O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-45(51)49-41-37-47(38-42-49)35-36-48-39-43-50(44-40-48)46(52)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15-18H,3-14,19-44H2,1-2H3/b17-15+,18-16+
Structural formula:
Chemical structure