N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C19H30N3O4S+ MolecularWeight: 396.5242

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C19H29N3O4S/c1-3-21-8-4-5-16(21)14-20-19(23)18-13-17(7-6-15(18)2)27(24,25)22-9-11-26-12-10-22/h6-7,13,16H,3-5,8-12,14H2,1-2H3,(H,20,23)/p+1/t16-/m1/s1