1-(3-phenylprop-2-ynyl)-1-prop-2-enyl-pyrrolidin-1-ium bromide

Systemtic Name: 1-(3-phenylprop-2-ynyl)-1-prop-2-enyl-pyrrolidin-1-ium bromide Openeye Name: 1-allyl-1-(3-phenylprop-2-ynyl)pyrrolidin-1-ium bromide CAS Name: 1-(3-phenylprop-2-ynyl)-1-prop-2-enylpyrrolidin-1-ium bromide IUPAC Name: 1-(3-phenylprop-2-ynyl)-1-prop-2-enylpyrrolidin-1-ium bromide Traditional Name: 1-allyl-1-(3-phenylprop-2-ynyl)pyrrolidin-1-ium bromide Formula: C16H20BrN MolecularWeight: 306.2407

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1(CCCC1)CC#CC2=CC=CC=C2.[Br-]

Isomeric SMILES

C=CC[N+]1(CCCC1)CC#CC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C16H20N.BrH/c1-2-12-17(13-6-7-14-17)15-8-11-16-9-4-3-5-10-16;/h2-5,9-10H,1,6-7,12-15H2;1H/q+1;/p-1