1-[5-ethynyl-2-(1-methoxyethoxymethoxy)phenyl]adamantane

Systemtic Name: 1-[5-ethynyl-2-(1-methoxyethoxymethoxy)phenyl]adamantane Openeye Name: 1-[5-ethynyl-2-(1-methoxyethoxymethoxy)phenyl]adamantane CAS Name: 1-[5-ethynyl-2-(1-methoxyethoxymethoxy)phenyl]adamantane IUPAC Name: 1-[5-ethynyl-2-(1-methoxyethoxymethoxy)phenyl]adamantane Traditional Name: 1-[5-ethynyl-2-(1-methoxyethoxymethoxy)phenyl]adamantane Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=C(C=C1)C#C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(OC)OCOC1=C(C=C(C=C1)C#C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28O3/c1-4-16-5-6-21(25-14-24-15(2)23-3)20(10-16)22-11-17-7-18(12-22)9-19(8-17)13-22/h1,5-6,10,15,17-19H,7-9,11-14H2,2-3H3