ethyl (E)-4-fluoranyl-2-methyl-4-pentyl-heptadec-2-enoate

Systemtic Name: ethyl (E)-4-fluoranyl-2-methyl-4-pentyl-heptadec-2-enoate Openeye Name: ethyl (E)-4-fluoro-2-methyl-4-pentyl-heptadec-2-enoate CAS Name: (E)-4-fluoro-2-methyl-4-pentyl-2-heptadecenoic acid ethyl ester IUPAC Name: ethyl (E)-4-fluoro-2-methyl-4-pentylheptadec-2-enoate Traditional Name: (E)-4-amyl-4-fluoro-2-methyl-heptadec-2-enoic acid ethyl ester Formula: C25H47FO2 MolecularWeight: 398.637883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCCCC)(C=C(C)C(=O)OCC)F

Isomeric SMILES

CCCCCCCCCCCCCC(CCCCC)(/C=C(\C)/C(=O)OCC)F

InChI

InChI=1S/C25H47FO2/c1-5-8-10-11-12-13-14-15-16-17-19-21-25(26,20-18-9-6-2)22-23(4)24(27)28-7-3/h22H,5-21H2,1-4H3/b23-22+