octadecyl 2-ethylcyclohexa-1,3-diene-1-carboxylate

Systemtic Name: octadecyl 2-ethylcyclohexa-1,3-diene-1-carboxylate Openeye Name: octadecyl 2-ethylcyclohexa-1,3-diene-1-carboxylate CAS Name: 2-ethyl-1-cyclohexa-1,3-dienecarboxylic acid octadecyl ester IUPAC Name: octadecyl 2-ethylcyclohexa-1,3-diene-1-carboxylate Traditional Name: 2-ethylcyclohexa-1,3-diene-1-carboxylic acid stearyl ester Formula: C27H48O2 MolecularWeight: 404.66882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=C(C=CCC1)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=C(C=CCC1)CC

InChI

InChI=1S/C27H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-29-27(28)26-23-20-19-22-25(26)4-2/h19,22H,3-18,20-21,23-24H2,1-2H3