1-[3-(4-chlorophenyl)prop-2-ynyl]-1-prop-2-enyl-piperidin-1-ium bromide

Systemtic Name: 1-[3-(4-chlorophenyl)prop-2-ynyl]-1-prop-2-enyl-piperidin-1-ium bromide Openeye Name: 1-allyl-1-[3-(4-chlorophenyl)prop-2-ynyl]piperidin-1-ium bromide CAS Name: 1-[3-(4-chlorophenyl)prop-2-ynyl]-1-prop-2-enylpiperidin-1-ium bromide IUPAC Name: 1-[3-(4-chlorophenyl)prop-2-ynyl]-1-prop-2-enylpiperidin-1-ium bromide Traditional Name: 1-allyl-1-[3-(4-chlorophenyl)prop-2-ynyl]piperidin-1-ium bromide Formula: C17H21BrClN MolecularWeight: 354.71234

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1(CCCCC1)CC#CC2=CC=C(C=C2)Cl.[Br-]

Isomeric SMILES

C=CC[N+]1(CCCCC1)CC#CC2=CC=C(C=C2)Cl.[Br-]

InChI

InChI=1S/C17H21ClN.BrH/c1-2-12-19(13-4-3-5-14-19)15-6-7-16-8-10-17(18)11-9-16;/h2,8-11H,1,3-5,12-15H2;1H/q+1;/p-1