1-[4-(1-adamantyl)-3-methoxy-phenyl]prop-2-yn-1-ol

Systemtic Name: 1-[4-(1-adamantyl)-3-methoxy-phenyl]prop-2-yn-1-ol Openeye Name: 1-[4-(1-adamantyl)-3-methoxy-phenyl]prop-2-yn-1-ol CAS Name: 1-[4-(1-adamantyl)-3-methoxyphenyl]-2-propyn-1-ol IUPAC Name: 1-[4-(1-adamantyl)-3-methoxyphenyl]prop-2-yn-1-ol Traditional Name: 1-[4-(1-adamantyl)-3-methoxy-phenyl]prop-2-yn-1-ol Formula: C20H24O2 MolecularWeight: 296.40336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24O2/c1-3-18(21)16-4-5-17(19(9-16)22-2)20-10-13-6-14(11-20)8-15(7-13)12-20/h1,4-5,9,13-15,18,21H,6-8,10-12H2,2H3