(E)-2,2-dimethyl-7-(1-naphthalen-1-ylethylamino)hept-5-en-3-yn-1-ol hydrochloride

Systemtic Name: (E)-2,2-dimethyl-7-(1-naphthalen-1-ylethylamino)hept-5-en-3-yn-1-ol hydrochloride Openeye Name: (E)-2,2-dimethyl-7-[1-(1-naphthyl)ethylamino]hept-5-en-3-yn-1-ol hydrochloride CAS Name: (E)-2,2-dimethyl-7-[1-(1-naphthalenyl)ethylamino]-1-hept-5-en-3-ynol hydrochloride IUPAC Name: (E)-2,2-dimethyl-7-(1-naphthalen-1-ylethylamino)hept-5-en-3-yn-1-ol hydrochloride Traditional Name: (E)-2,2-dimethyl-7-[1-(1-naphthyl)ethylamino]hept-5-en-3-yn-1-ol hydrochloride Formula: C21H26ClNO MolecularWeight: 343.89024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NCC=CC#CC(C)(C)CO.Cl

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC/C=C/C#CC(C)(C)CO.Cl

InChI

InChI=1S/C21H25NO.ClH/c1-17(22-15-8-4-7-14-21(2,3)16-23)19-13-9-11-18-10-5-6-12-20(18)19;/h4-6,8-13,17,22-23H,15-16H2,1-3H3;1H/b8-4+;