(E)-6-methoxy-6-methyl-N-(1-naphthalen-1-ylethyl)hept-2-en-4-yn-1-amine hydrochloride

Systemtic Name: (E)-6-methoxy-6-methyl-N-(1-naphthalen-1-ylethyl)hept-2-en-4-yn-1-amine hydrochloride Openeye Name: (E)-6-methoxy-6-methyl-N-[1-(1-naphthyl)ethyl]hept-2-en-4-yn-1-amine hydrochloride CAS Name: (E)-6-methoxy-6-methyl-N-[1-(1-naphthalenyl)ethyl]-1-hept-2-en-4-ynamine hydrochloride IUPAC Name: (E)-6-methoxy-6-methyl-N-(1-naphthalen-1-ylethyl)hept-2-en-4-yn-1-amine hydrochloride Traditional Name: [(E)-6-methoxy-6-methyl-hept-2-en-4-ynyl]-[1-(1-naphthyl)ethyl]amine hydrochloride Formula: C21H26ClNO MolecularWeight: 343.89024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO.ClH/c1-17(22-16-9-5-8-15-21(2,3)23-4)19-14-10-12-18-11-6-7-13-20(18)19;/h5-7,9-14,17,22H,16H2,1-4H3;1H/b9-5+;