(2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-yl) octadecanoate

Systemtic Name: (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-yl) octadecanoate Openeye Name: (2-hexadecyl-2,5,7,8-tetramethyl-chroman-6-yl) octadecanoate CAS Name: octadecanoic acid (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl) ester IUPAC Name: (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-yl) octadecanoate Traditional Name: stearic acid (2-cetyl-2,5,7,8-tetramethyl-chroman-6-yl) ester Formula: C47H84O3 MolecularWeight: 697.16806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=C(C(=C2C(=C1C)CCC(O2)(C)CCCCCCCCCCCCCCCC)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=C(C(=C2C(=C1C)CCC(O2)(C)CCCCCCCCCCCCCCCC)C)C

InChI

InChI=1S/C47H84O3/c1-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-44(48)49-45-40(3)41(4)46-43(42(45)5)37-39-47(6,50-46)38-35-33-31-29-27-25-22-20-18-16-14-12-10-8-2/h7-39H2,1-6H3