(E)-N'-[6-[[(E)-18-azanyl-12-oxidanyl-18-oxidanylidene-octadec-9-enoyl]amino]hexyl]-7-oxidanyl-octadec-9-enediamide

Systemtic Name: (E)-N'-[6-[[(E)-18-azanyl-12-oxidanyl-18-oxidanylidene-octadec-9-enoyl]amino]hexyl]-7-oxidanyl-octadec-9-enediamide Openeye Name: (E)-N'-[6-[[(E)-18-amino-12-hydroxy-18-oxo-octadec-9-enoyl]amino]hexyl]-7-hydroxy-octadec-9-enediamide CAS Name: (E)-N'-[6-[[(E)-18-amino-12-hydroxy-1,18-dioxooctadec-9-enyl]amino]hexyl]-7-hydroxy-9-octadecenediamide IUPAC Name: (E)-N'-[6-[[(E)-18-amino-12-hydroxy-18-oxooctadec-9-enoyl]amino]hexyl]-7-hydroxyoctadec-9-enediamide Traditional Name: (E)-N'-[6-[[(E)-18-amino-12-hydroxy-18-keto-octadec-9-enoyl]amino]hexyl]-7-hydroxy-octadec-9-enediamide Formula: C42H78N4O6 MolecularWeight: 735.09192

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCC=CCC(CCCCCC(=O)N)O)CCCC(=O)NCCCCCCNC(=O)CCCCCCCC=CCC(CCCCCC(=O)N)O

Isomeric SMILES

C(CCCC(=O)NCCCCCCNC(=O)CCCCCCC/C=C/CC(O)CCCCCC(=O)N)CCC/C=C/CC(O)CCCCCC(=O)N

InChI

InChI=1S/C42H78N4O6/c43-39(49)31-21-15-19-29-37(47)27-17-9-5-1-3-7-11-23-33-41(51)45-35-25-13-14-26-36-46-42(52)34-24-12-8-4-2-6-10-18-28-38(48)30-20-16-22-32-40(44)50/h9-10,17-18,37-38,47-48H,1-8,11-16,19-36H2,(H2,43,49)(H2,44,50)(H,45,51)(H,46,52)/b17-9+,18-10+