2,2-bis[(E)-octadec-9-enoyl]decanedioic acid

Systemtic Name: 2,2-bis[(E)-octadec-9-enoyl]decanedioic acid Openeye Name: 2,2-bis[(E)-octadec-9-enoyl]decanedioic acid CAS Name: 2,2-bis[(E)-1-oxooctadec-9-enyl]decanedioic acid IUPAC Name: 2,2-bis[(E)-octadec-9-enoyl]decanedioic acid Traditional Name: 2,2-bis[(E)-octadec-9-enoyl]sebacic acid Formula: C46H82O6 MolecularWeight: 731.13968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C(CCCCCCCC(=O)O)(C(=O)CCCCCCCC=CCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C(C(=O)O)(C(=O)CCCCCCC/C=C/CCCCCCCC)CCCCCCCC(=O)O

InChI

InChI=1S/C46H82O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-34-38-42(47)46(45(51)52,41-37-33-29-32-36-40-44(49)50)43(48)39-35-31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-41H2,1-2H3,(H,49,50)(H,51,52)/b19-17+,20-18+