(2-methyl-2-adamantyl) 6-[4-(1-ethoxyethoxy)phenyl]-2-ethyl-4-(4-hydroxyphenyl)-2-methyl-heptanoate

Systemtic Name: (2-methyl-2-adamantyl) 6-[4-(1-ethoxyethoxy)phenyl]-2-ethyl-4-(4-hydroxyphenyl)-2-methyl-heptanoate Openeye Name: (2-methyl-2-adamantyl) 6-[4-(1-ethoxyethoxy)phenyl]-2-ethyl-4-(4-hydroxyphenyl)-2-methyl-heptanoate CAS Name: 6-[4-(1-ethoxyethoxy)phenyl]-2-ethyl-4-(4-hydroxyphenyl)-2-methylheptanoic acid (2-methyl-2-adamantyl) ester IUPAC Name: (2-methyl-2-adamantyl) 6-[4-(1-ethoxyethoxy)phenyl]-2-ethyl-4-(4-hydroxyphenyl)-2-methylheptanoate Traditional Name: 6-[4-(1-ethoxyethoxy)phenyl]-2-ethyl-4-(4-hydroxyphenyl)-2-methyl-enanthic acid (2-methyl-2-adamantyl) ester Formula: C37H52O5 MolecularWeight: 576.80578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(CC(C)C1=CC=C(C=C1)OC(C)OCC)C2=CC=C(C=C2)O)C(=O)OC3(C4CC5CC(C4)CC3C5)C

Isomeric SMILES

CCC(C)(CC(CC(C)C1=CC=C(C=C1)OC(C)OCC)C2=CC=C(C=C2)O)C(=O)OC3(C4CC5CC(C4)CC3C5)C

InChI

InChI=1S/C37H52O5/c1-7-36(5,35(39)42-37(6)31-19-26-18-27(21-31)22-32(37)20-26)23-30(29-9-13-33(38)14-10-29)17-24(3)28-11-15-34(16-12-28)41-25(4)40-8-2/h9-16,24-27,30-32,38H,7-8,17-23H2,1-6H3