octadecyl (E)-2-methyl-3-oxidanyl-prop-2-enoate

Systemtic Name: octadecyl (E)-2-methyl-3-oxidanyl-prop-2-enoate Openeye Name: octadecyl (E)-3-hydroxy-2-methyl-prop-2-enoate CAS Name: (E)-3-hydroxy-2-methyl-2-propenoic acid octadecyl ester IUPAC Name: octadecyl (E)-3-hydroxy-2-methylprop-2-enoate Traditional Name: (E)-3-hydroxy-2-methyl-acrylic acid stearyl ester Formula: C22H42O3 MolecularWeight: 354.56708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(=CO)C

Isomeric SMILES

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

InChI

InChI=1S/C22H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-22(24)21(2)20-23/h20,23H,3-19H2,1-2H3/b21-20+