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dihexadecyl 2-[(E)-octadec-1-enyl]butanedioate

Systemtic Name:	dihexadecyl 2-[(E)-octadec-1-enyl]butanedioate
Openeye Name:	dihexadecyl 2-[(E)-octadec-1-enyl]butanedioate
CAS Name:	2-[(E)-octadec-1-enyl]butanedioic acid dihexadecyl ester
IUPAC Name:	dihexadecyl 2-[(E)-octadec-1-enyl]butanedioate
Traditional Name:	2-[(E)-octadec-1-enyl]succinic acid dicetyl ester
Formula:	C₅₄H₁₀₄O₄
MolecularWeight:	817.40116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=CC(CC(=O)OCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/C(CC(=O)OCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C54H104O4/c1-4-7-10-13-16-19-22-25-28-29-30-33-36-39-42-45-48-52(54(56)58-50-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)51-53(55)57-49-46-43-40-37-34-31-26-23-20-17-14-11-8-5-2/h45,48,52H,4-44,46-47,49-51H2,1-3H3/b48-45+

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