1-[3-(4-methylphenyl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide

Systemtic Name: 1-[3-(4-methylphenyl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide Openeye Name: 1-(3-phenylprop-2-ynyl)-1-[3-(p-tolyl)prop-2-ynyl]piperidin-1-ium bromide CAS Name: 1-[3-(4-methylphenyl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide IUPAC Name: 1-[3-(4-methylphenyl)prop-2-ynyl]-1-(3-phenylprop-2-ynyl)piperidin-1-ium bromide Traditional Name: 1-(3-phenylprop-2-ynyl)-1-[3-(p-tolyl)prop-2-ynyl]piperidin-1-ium bromide Formula: C24H26BrN MolecularWeight: 408.37394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC[N+]2(CCCCC2)CC#CC3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C#CC[N+]2(CCCCC2)CC#CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C24H26N.BrH/c1-22-14-16-24(17-15-22)13-9-21-25(18-6-3-7-19-25)20-8-12-23-10-4-2-5-11-23;/h2,4-5,10-11,14-17H,3,6-7,18-21H2,1H3;1H/q+1;/p-1