1-[3-(cyclohexen-1-yl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide

Systemtic Name: 1-[3-(cyclohexen-1-yl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide Openeye Name: 1-[3-(cyclohexen-1-yl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide CAS Name: 1-[3-(1-cyclohexenyl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide IUPAC Name: 1-[3-(cyclohexen-1-yl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide Traditional Name: 1-[3-(cyclohexen-1-yl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide Formula: C23H28BrN MolecularWeight: 398.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC#CC2=CCCCC2)CC#CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1CC[N+](CC1)(CC#CC2=CCCCC2)CC#CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C23H28N.BrH/c1-4-12-22(13-5-1)16-10-20-24(18-8-3-9-19-24)21-11-17-23-14-6-2-7-15-23;/h1,4-5,12-14H,2-3,6-9,15,18-21H2;1H/q+1;/p-1