(2Z)-2-methyl-5-octadecoxycarbonyl-hexa-2,5-dienoic acid

Systemtic Name: (2Z)-2-methyl-5-octadecoxycarbonyl-hexa-2,5-dienoic acid Openeye Name: (2Z)-2-methyl-5-octadecoxycarbonyl-hexa-2,5-dienoic acid CAS Name: (2Z)-2-methyl-5-[octadecoxy(oxo)methyl]hexa-2,5-dienoic acid IUPAC Name: (2Z)-2-methyl-5-octadecoxycarbonylhexa-2,5-dienoic acid Traditional Name: (2Z)-2-methyl-5-stearyloxycarbonyl-hexa-2,5-dienoic acid Formula: C26H46O4 MolecularWeight: 422.64104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(=C)CC=C(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C/C=C(/C)\C(=O)O

InChI

InChI=1S/C26H46O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30-26(29)24(3)21-20-23(2)25(27)28/h20H,3-19,21-22H2,1-2H3,(H,27,28)/b23-20-