N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-ethylsulfonyl-2-methoxy-benzamide

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-ethylsulfonyl-2-methoxy-benzamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-ethylsulfonyl-2-methoxy-benzamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-5-ethylsulfonyl-2-methoxybenzamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-ethylsulfonyl-2-methoxybenzamide Traditional Name: 5-esyl-N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methoxy-benzamide Formula: C17H27N2O4S+ MolecularWeight: 355.47228

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)CC)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O4S/c1-4-19-10-6-7-13(19)12-18-17(20)15-11-14(24(21,22)5-2)8-9-16(15)23-3/h8-9,11,13H,4-7,10,12H2,1-3H3,(H,18,20)/p+1/t13-/m1/s1