2-[(E)-16-hexyltetratriacont-25-en-16-yl]oxycarbonylbenzoic acid

Systemtic Name: 2-[(E)-16-hexyltetratriacont-25-en-16-yl]oxycarbonylbenzoic acid Openeye Name: 2-[(E)-1-hexyl-1-pentadecyl-nonadec-10-enoxy]carbonylbenzoic acid CAS Name: 2-[[(E)-16-hexyltetratriacont-25-en-16-yl]oxy-oxomethyl]benzoic acid IUPAC Name: 2-[(E)-16-hexyltetratriacont-25-en-16-yl]oxycarbonylbenzoic acid Traditional Name: 2-[(E)-1-hexyl-1-pentadecyl-nonadec-10-enoxy]carbonylbenzoic acid Formula: C48H84O4 MolecularWeight: 725.17816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CCCCCC)(CCCCCCCCC=CCCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(CCCCCC)(CCCCCCCC/C=C/CCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C48H84O4/c1-4-7-10-13-15-17-19-21-22-23-25-27-29-31-33-38-43-48(41-36-12-9-6-3,52-47(51)45-40-35-34-39-44(45)46(49)50)42-37-32-30-28-26-24-20-18-16-14-11-8-5-2/h21-22,34-35,39-40H,4-20,23-33,36-38,41-43H2,1-3H3,(H,49,50)/b22-21+