decyl (E)-octadec-9-enoate; octadecan-2-ol

Systemtic Name: decyl (E)-octadec-9-enoate; octadecan-2-ol Openeye Name: decyl (E)-octadec-9-enoate; octadecan-2-ol CAS Name: 2-octadecanol; (E)-9-octadecenoic acid decyl ester IUPAC Name: decyl (E)-octadec-9-enoate; octadecan-2-ol Traditional Name: octadecan-2-ol; (E)-octadec-9-enoic acid decyl ester Formula: C46H92O3 MolecularWeight: 693.22088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)O.CCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)O.CCCCCCCCCCOC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C28H54O2.C18H38O/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28(29)30-27-25-23-21-12-10-8-6-4-2;1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)19/h15-16H,3-14,17-27H2,1-2H3;18-19H,3-17H2,1-2H3/b16-15+;