methyl (E)-octadec-9-enoate; propane-1,2,3-triol

Systemtic Name: methyl (E)-octadec-9-enoate; propane-1,2,3-triol Openeye Name: glycerol; methyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid methyl ester; propane-1,2,3-triol IUPAC Name: methyl (E)-octadec-9-enoate; propane-1,2,3-triol Traditional Name: glycerol; (E)-octadec-9-enoic acid methyl ester Formula: C22H44O5 MolecularWeight: 388.58176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC.C(C(CO)O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC.C(C(CO)O)O

InChI

InChI=1S/C19H36O2.C3H8O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2;4-1-3(6)2-5/h10-11H,3-9,12-18H2,1-2H3;3-6H,1-2H2/b11-10+;