N1,N3-bis[(E)-octadec-9-enoyl]-N5-octadecyl-cyclohexane-1,3,5-tricarboxamide

Systemtic Name: N1,N3-bis[(E)-octadec-9-enoyl]-N5-octadecyl-cyclohexane-1,3,5-tricarboxamide Openeye Name: N1,N3-bis[(E)-octadec-9-enoyl]-N5-octadecyl-cyclohexane-1,3,5-tricarboxamide CAS Name: N5-octadecyl-N1,N3-bis[(E)-1-oxooctadec-9-enyl]cyclohexane-1,3,5-tricarboxamide IUPAC Name: 1-N,3-N-bis[(E)-octadec-9-enoyl]-5-N-octadecylcyclohexane-1,3,5-tricarboxamide Traditional Name: N1,N3-bis[(E)-octadec-9-enoyl]-N5-stearyl-cyclohexane-1,3,5-tricarboxamide Formula: C63H115N3O5 MolecularWeight: 994.6043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1CC(CC(C1)C(=O)NC(=O)CCCCCCCC=CCCCCCCCC)C(=O)NC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1CC(CC(C1)C(=O)NC(=O)CCCCCCC/C=C/CCCCCCCC)C(=O)NC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C63H115N3O5/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-64-61(69)56-53-57(62(70)65-59(67)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)55-58(54-56)63(71)66-60(68)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h26-27,29-30,56-58H,4-25,28,31-55H2,1-3H3,(H,64,69)(H,65,67,70)(H,66,68,71)/b29-26+,30-27+