[4-[2-(4-methoxy-3,5-dimethyl-phenyl)-2-adamantyl]-2,6-dimethyl-phenyl] ethanoate

Systemtic Name: [4-[2-(4-methoxy-3,5-dimethyl-phenyl)-2-adamantyl]-2,6-dimethyl-phenyl] ethanoate Openeye Name: [4-[2-(4-methoxy-3,5-dimethyl-phenyl)-2-adamantyl]-2,6-dimethyl-phenyl] acetate CAS Name: acetic acid [4-[2-(4-methoxy-3,5-dimethylphenyl)-2-adamantyl]-2,6-dimethylphenyl] ester IUPAC Name: [4-[2-(4-methoxy-3,5-dimethylphenyl)-2-adamantyl]-2,6-dimethylphenyl] acetate Traditional Name: acetic acid [4-[2-(4-methoxy-3,5-dimethyl-phenyl)-2-adamantyl]-2,6-dimethyl-phenyl] ester Formula: C29H36O3 MolecularWeight: 432.59434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)C2(C3CC4CC(C3)CC2C4)C5=CC(=C(C(=C5)C)OC(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)C2(C3CC4CC(C3)CC2C4)C5=CC(=C(C(=C5)C)OC(=O)C)C

InChI

InChI=1S/C29H36O3/c1-16-7-23(8-17(2)27(16)31-6)29(25-12-21-11-22(14-25)15-26(29)13-21)24-9-18(3)28(19(4)10-24)32-20(5)30/h7-10,21-22,25-26H,11-15H2,1-6H3