carboxy 2-[(E)-hexadec-7-enyl]tetracosanoate

Systemtic Name: carboxy 2-[(E)-hexadec-7-enyl]tetracosanoate Openeye Name: carboxy 2-[(E)-hexadec-7-enyl]tetracosanoate CAS Name: 2-[(E)-hexadec-7-enyl]tetracosanoic acid carboxy ester IUPAC Name: carboxy 2-[(E)-hexadec-7-enyl]tetracosanoate Traditional Name: (E)-2-behenyloctadec-9-enoic acid carboxy ester Formula: C41H78O4 MolecularWeight: 635.05562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(CCCCCCC=CCCCCCCCC)C(=O)OC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC(CCCCCC/C=C/CCCCCCCC)C(=O)OC(=O)O

InChI

InChI=1S/C41H78O4/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-39(40(42)45-41(43)44)37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h18,25,39H,3-17,19-24,26-38H2,1-2H3,(H,43,44)/b25-18+