[(Z)-3,7,11,15-tetramethylhexadec-2-enyl] 8-(3-octyloxiran-2-yl)octanoate

Systemtic Name: [(Z)-3,7,11,15-tetramethylhexadec-2-enyl] 8-(3-octyloxiran-2-yl)octanoate Openeye Name: [(Z)-3,7,11,15-tetramethylhexadec-2-enyl] 8-(3-octyloxiran-2-yl)octanoate CAS Name: 8-(3-octyl-2-oxiranyl)octanoic acid [(Z)-3,7,11,15-tetramethylhexadec-2-enyl] ester IUPAC Name: [(Z)-3,7,11,15-tetramethylhexadec-2-enyl] 8-(3-octyloxiran-2-yl)octanoate Traditional Name: 8-(3-octyloxiran-2-yl)caprylic acid [(Z)-3,7,11,15-tetramethylhexadec-2-enyl] ester Formula: C38H72O3 MolecularWeight: 576.97648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(O1)CCCCCCCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C

Isomeric SMILES

CCCCCCCCC1C(O1)CCCCCCCC(=O)OC/C=C(/C)\CCCC(C)CCCC(C)CCCC(C)C

InChI

InChI=1S/C38H72O3/c1-7-8-9-10-12-15-27-36-37(41-36)28-16-13-11-14-17-29-38(39)40-31-30-35(6)26-20-25-34(5)24-19-23-33(4)22-18-21-32(2)3/h30,32-34,36-37H,7-29,31H2,1-6H3/b35-30-