[4-[3-(4-methoxyphenyl)-1-adamantyl]phenyl] ethanoate

Systemtic Name: [4-[3-(4-methoxyphenyl)-1-adamantyl]phenyl] ethanoate Openeye Name: [4-[3-(4-methoxyphenyl)-1-adamantyl]phenyl] acetate CAS Name: acetic acid [4-[3-(4-methoxyphenyl)-1-adamantyl]phenyl] ester IUPAC Name: [4-[3-(4-methoxyphenyl)-1-adamantyl]phenyl] acetate Traditional Name: acetic acid [4-[3-(4-methoxyphenyl)-1-adamantyl]phenyl] ester Formula: C25H28O3 MolecularWeight: 376.48802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C25H28O3/c1-17(26)28-23-9-5-21(6-10-23)25-14-18-11-19(15-25)13-24(12-18,16-25)20-3-7-22(27-2)8-4-20/h3-10,18-19H,11-16H2,1-2H3