hexyl 2-(2-hexadecyl-6-methoxy-2,7,8-trimethyl-3,4-dihydrochromen-5-yl)ethanoate

Systemtic Name: hexyl 2-(2-hexadecyl-6-methoxy-2,7,8-trimethyl-3,4-dihydrochromen-5-yl)ethanoate Openeye Name: hexyl 2-(2-hexadecyl-6-methoxy-2,7,8-trimethyl-chroman-5-yl)acetate CAS Name: 2-(2-hexadecyl-6-methoxy-2,7,8-trimethyl-3,4-dihydro-2H-1-benzopyran-5-yl)acetic acid hexyl ester IUPAC Name: hexyl 2-(2-hexadecyl-6-methoxy-2,7,8-trimethyl-3,4-dihydrochromen-5-yl)acetate Traditional Name: 2-(2-cetyl-6-methoxy-2,7,8-trimethyl-chroman-5-yl)acetic acid hexyl ester Formula: C37H64O4 MolecularWeight: 572.90166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1(CCC2=C(C(=C(C(=C2O1)C)C)OC)CC(=O)OCCCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC1(CCC2=C(C(=C(C(=C2O1)C)C)OC)CC(=O)OCCCCCC)C

InChI

InChI=1S/C37H64O4/c1-7-9-11-13-14-15-16-17-18-19-20-21-22-23-26-37(5)27-25-32-33(29-34(38)40-28-24-12-10-8-2)35(39-6)30(3)31(4)36(32)41-37/h7-29H2,1-6H3