1-[2,2-bis(phenylsulfonyl)ethenyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[2,2-bis(phenylsulfonyl)ethenyl]-4-methyl-piperidin-1-ium Openeye Name: 1-[2,2-bis(benzenesulfonyl)vinyl]-4-methyl-piperidin-1-ium CAS Name: 1-[2,2-bis(benzenesulfonyl)ethenyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[2,2-bis(benzenesulfonyl)ethenyl]-4-methylpiperidin-1-ium Traditional Name: 1-(2,2-dibesylvinyl)-4-methyl-piperidin-1-ium Formula: C20H24NO4S2+ MolecularWeight: 406.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C=C(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1CC[NH+](CC1)C=C(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S2/c1-17-12-14-21(15-13-17)16-20(26(22,23)18-8-4-2-5-9-18)27(24,25)19-10-6-3-7-11-19/h2-11,16-17H,12-15H2,1H3/p+1