octadecyl 3-(3-tert-butyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: octadecyl 3-(3-tert-butyl-4-oxidanyl-phenyl)propanoate Openeye Name: octadecyl 3-(3-tert-butyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3-tert-butyl-4-hydroxyphenyl)propanoic acid octadecyl ester IUPAC Name: octadecyl 3-(3-tert-butyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3-tert-butyl-4-hydroxy-phenyl)propionic acid stearyl ester Formula: C31H54O3 MolecularWeight: 474.75866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H54O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-34-30(33)24-22-27-21-23-29(32)28(26-27)31(2,3)4/h21,23,26,32H,5-20,22,24-25H2,1-4H3