1,1-bis[(E)-3-chloranylbut-2-enyl]piperidin-1-ium chloride

Systemtic Name: 1,1-bis[(E)-3-chloranylbut-2-enyl]piperidin-1-ium chloride Openeye Name: 1,1-bis[(E)-3-chlorobut-2-enyl]piperidin-1-ium chloride CAS Name: 1,1-bis[(E)-3-chlorobut-2-enyl]piperidin-1-ium chloride IUPAC Name: 1,1-bis[(E)-3-chlorobut-2-enyl]piperidin-1-ium chloride Traditional Name: 1,1-bis[(E)-3-chlorobut-2-enyl]piperidin-1-ium chloride Formula: C13H22Cl3N MolecularWeight: 298.67948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[N+]1(CCCCC1)CC=C(C)Cl)Cl.[Cl-]

Isomeric SMILES

C/C(=C\C[N+]1(CCCCC1)C/C=C(/Cl)\C)/Cl.[Cl-]

InChI

InChI=1S/C13H22Cl2N.ClH/c1-12(14)6-10-16(11-7-13(2)15)8-4-3-5-9-16;/h6-7H,3-5,8-11H2,1-2H3;1H/q+1;/p-1/b12-6+,13-7+;