N,N-diethyl-2-[4-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-(1-tosylisonipecotoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H37N4O4S+ MolecularWeight: 465.62928

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H36N4O4S/c1-4-25(5-2)22(28)18-24-14-16-26(17-15-24)23(29)20-10-12-27(13-11-20)32(30,31)21-8-6-19(3)7-9-21/h6-9,20H,4-5,10-18H2,1-3H3/p+1