1-(3-naphthalen-1-ylprop-2-ynyl)-1-prop-2-enyl-piperidin-1-ium bromide

Systemtic Name: 1-(3-naphthalen-1-ylprop-2-ynyl)-1-prop-2-enyl-piperidin-1-ium bromide Openeye Name: 1-allyl-1-[3-(1-naphthyl)prop-2-ynyl]piperidin-1-ium bromide CAS Name: 1-[3-(1-naphthalenyl)prop-2-ynyl]-1-prop-2-enylpiperidin-1-ium bromide IUPAC Name: 1-(3-naphthalen-1-ylprop-2-ynyl)-1-prop-2-enylpiperidin-1-ium bromide Traditional Name: 1-allyl-1-[3-(1-naphthyl)prop-2-ynyl]piperidin-1-ium bromide Formula: C21H24BrN MolecularWeight: 370.32596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1(CCCCC1)CC#CC2=CC=CC3=CC=CC=C32.[Br-]

Isomeric SMILES

C=CC[N+]1(CCCCC1)CC#CC2=CC=CC3=CC=CC=C32.[Br-]

InChI

InChI=1S/C21H24N.BrH/c1-2-15-22(16-6-3-7-17-22)18-9-13-20-12-8-11-19-10-4-5-14-21(19)20;/h2,4-5,8,10-12,14H,1,3,6-7,15-18H2;1H/q+1;/p-1