3-chloranyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-(1-methylsulfonylpiperidin-4-yl)oxy-benzamide

Systemtic Name: 3-chloranyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-(1-methylsulfonylpiperidin-4-yl)oxy-benzamide Openeye Name: 3-chloro-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-[(1-methylsulfonyl-4-piperidyl)oxy]benzamide CAS Name: 3-chloro-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-[(1-methylsulfonyl-4-piperidinyl)oxy]benzamide IUPAC Name: 3-chloro-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-(1-methylsulfonylpiperidin-4-yl)oxybenzamide Traditional Name: 3-chloro-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-[(1-mesyl-4-piperidyl)oxy]benzamide Formula: C20H31ClN3O4S+ MolecularWeight: 444.99584

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=CC(=C(C=C2)OC3CCN(CC3)S(=O)(=O)C)Cl

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=CC(=C(C=C2)OC3CCN(CC3)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H30ClN3O4S/c1-3-23-10-4-5-16(23)14-22-20(25)15-6-7-19(18(21)13-15)28-17-8-11-24(12-9-17)29(2,26)27/h6-7,13,16-17H,3-5,8-12,14H2,1-2H3,(H,22,25)/p+1/t16-/m0/s1