octadecyl 3-(3,5-dimethyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: octadecyl 3-(3,5-dimethyl-4-oxidanyl-phenyl)propanoate Openeye Name: octadecyl 3-(4-hydroxy-3,5-dimethyl-phenyl)propanoate CAS Name: 3-(4-hydroxy-3,5-dimethylphenyl)propanoic acid octadecyl ester IUPAC Name: octadecyl 3-(4-hydroxy-3,5-dimethylphenyl)propanoate Traditional Name: 3-(4-hydroxy-3,5-dimethyl-phenyl)propionic acid stearyl ester Formula: C29H50O3 MolecularWeight: 446.7055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H50O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-32-28(30)21-20-27-23-25(2)29(31)26(3)24-27/h23-24,31H,4-22H2,1-3H3