heptyl (E)-octadec-10-enoate

Systemtic Name: heptyl (E)-octadec-10-enoate Openeye Name: heptyl (E)-octadec-10-enoate CAS Name: (E)-10-octadecenoic acid heptyl ester IUPAC Name: heptyl (E)-octadec-10-enoate Traditional Name: (E)-octadec-10-enoic acid heptyl ester Formula: C25H48O2 MolecularWeight: 380.64742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CCCCCCCCCC(=O)OCCCCCCC

Isomeric SMILES

CCCCCCC/C=C/CCCCCCCCC(=O)OCCCCCCC

InChI

InChI=1S/C25H48O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-21-23-25(26)27-24-22-20-8-6-4-2/h12-13H,3-11,14-24H2,1-2H3/b13-12+