3-[2-(1-adamantyl)-4-ethynyl-phenoxy]-2-methyl-propan-1-ol

Systemtic Name: 3-[2-(1-adamantyl)-4-ethynyl-phenoxy]-2-methyl-propan-1-ol Openeye Name: 3-[2-(1-adamantyl)-4-ethynyl-phenoxy]-2-methyl-propan-1-ol CAS Name: 3-[2-(1-adamantyl)-4-ethynylphenoxy]-2-methyl-1-propanol IUPAC Name: 3-[2-(1-adamantyl)-4-ethynylphenoxy]-2-methylpropan-1-ol Traditional Name: 3-[2-(1-adamantyl)-4-ethynyl-phenoxy]-2-methyl-propan-1-ol Formula: C22H28O2 MolecularWeight: 324.45652

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)COC1=C(C=C(C=C1)C#C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(CO)COC1=C(C=C(C=C1)C#C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28O2/c1-3-16-4-5-21(24-14-15(2)13-23)20(9-16)22-10-17-6-18(11-22)8-19(7-17)12-22/h1,4-5,9,15,17-19,23H,6-8,10-14H2,2H3