4-[2-[3-(1-adamantyl)thiophen-2-yl]ethynyl]phenol

Systemtic Name: 4-[2-[3-(1-adamantyl)thiophen-2-yl]ethynyl]phenol Openeye Name: 4-[2-[3-(1-adamantyl)-2-thienyl]ethynyl]phenol CAS Name: 4-[2-[3-(1-adamantyl)-2-thiophenyl]ethynyl]phenol IUPAC Name: 4-[2-[3-(1-adamantyl)thiophen-2-yl]ethynyl]phenol Traditional Name: 4-[2-[3-(1-adamantyl)-2-thienyl]ethynyl]phenol Formula: C22H22OS MolecularWeight: 334.47448

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C(SC=C4)C#CC5=CC=C(C=C5)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C(SC=C4)C#CC5=CC=C(C=C5)O

InChI

InChI=1S/C22H22OS/c23-19-4-1-15(2-5-19)3-6-21-20(7-8-24-21)22-12-16-9-17(13-22)11-18(10-16)14-22/h1-2,4-5,7-8,16-18,23H,9-14H2