butan-2-yl (E)-octadec-9-enoate

Systemtic Name: butan-2-yl (E)-octadec-9-enoate Openeye Name: sec-butyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid butan-2-yl ester IUPAC Name: butan-2-yl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid sec-butyl ester Formula: C22H42O2 MolecularWeight: 338.56768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C)CC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C)CC

InChI

InChI=1S/C22H42O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21(3)5-2/h12-13,21H,4-11,14-20H2,1-3H3/b13-12+