octadecyl 2-[3-methyl-4-oxidanyl-5-(1-phenylethyl)phenyl]propanoate

Systemtic Name: octadecyl 2-[3-methyl-4-oxidanyl-5-(1-phenylethyl)phenyl]propanoate Openeye Name: octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate CAS Name: 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoic acid octadecyl ester IUPAC Name: octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate Traditional Name: 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propionic acid stearyl ester Formula: C36H56O3 MolecularWeight: 536.82804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(C)C1=CC(=C(C(=C1)C(C)C2=CC=CC=C2)O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(C)C1=CC(=C(C(=C1)C(C)C2=CC=CC=C2)O)C

InChI

InChI=1S/C36H56O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-39-36(38)31(4)33-27-29(2)35(37)34(28-33)30(3)32-24-21-20-22-25-32/h20-22,24-25,27-28,30-31,37H,5-19,23,26H2,1-4H3