1-[5-ethynyl-2-[1-(methoxymethoxy)propyl]phenyl]adamantane

Systemtic Name: 1-[5-ethynyl-2-[1-(methoxymethoxy)propyl]phenyl]adamantane Openeye Name: 1-[5-ethynyl-2-[1-(methoxymethoxy)propyl]phenyl]adamantane CAS Name: 1-[5-ethynyl-2-[1-(methoxymethoxy)propyl]phenyl]adamantane IUPAC Name: 1-[5-ethynyl-2-[1-(methoxymethoxy)propyl]phenyl]adamantane Traditional Name: 1-[5-ethynyl-2-[1-(methoxymethoxy)propyl]phenyl]adamantane Formula: C23H30O2 MolecularWeight: 338.4831

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1)C#C)C23CC4CC(C2)CC(C4)C3)OCOC

Isomeric SMILES

CCC(C1=C(C=C(C=C1)C#C)C23CC4CC(C2)CC(C4)C3)OCOC

InChI

InChI=1S/C23H30O2/c1-4-16-6-7-20(22(5-2)25-15-24-3)21(11-16)23-12-17-8-18(13-23)10-19(9-17)14-23/h1,6-7,11,17-19,22H,5,8-10,12-15H2,2-3H3