1,4-bis(4-bromophenyl)-4-but-3-enyl-1-methyl-piperidin-1-ium

Systemtic Name: 1,4-bis(4-bromophenyl)-4-but-3-enyl-1-methyl-piperidin-1-ium Openeye Name: 1,4-bis(4-bromophenyl)-4-but-3-enyl-1-methyl-piperidin-1-ium CAS Name: 1,4-bis(4-bromophenyl)-4-but-3-enyl-1-methylpiperidin-1-ium IUPAC Name: 1,4-bis(4-bromophenyl)-4-but-3-enyl-1-methylpiperidin-1-ium Traditional Name: 1,4-bis(4-bromophenyl)-4-but-3-enyl-1-methyl-piperidin-1-ium Formula: C22H26Br2N+ MolecularWeight: 464.25654

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)(CCC=C)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br

Isomeric SMILES

C[N+]1(CCC(CC1)(CCC=C)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H26Br2N/c1-3-4-13-22(18-5-7-19(23)8-6-18)14-16-25(2,17-15-22)21-11-9-20(24)10-12-21/h3,5-12H,1,4,13-17H2,2H3/q+1