1-(tert-butylamino)-3-[2-(2-phenylethynyl)phenoxy]propan-2-ol hydrochloride

Systemtic Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)phenoxy]propan-2-ol hydrochloride Openeye Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)phenoxy]propan-2-ol hydrochloride CAS Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)phenoxy]-2-propanol hydrochloride IUPAC Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)phenoxy]propan-2-ol hydrochloride Traditional Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)phenoxy]propan-2-ol hydrochloride Formula: C21H26ClNO2 MolecularWeight: 359.88964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC=C1C#CC2=CC=CC=C2)O.Cl

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC=C1C#CC2=CC=CC=C2)O.Cl

InChI

InChI=1S/C21H25NO2.ClH/c1-21(2,3)22-15-19(23)16-24-20-12-8-7-11-18(20)14-13-17-9-5-4-6-10-17;/h4-12,19,22-23H,15-16H2,1-3H3;1H