4-chloranyl-N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-morpholinosulfonyl-benzamide CAS Name: 4-chloro-N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-morpholinosulfonyl-benzamide Formula: C18H27ClN3O4S+ MolecularWeight: 416.94268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26ClN3O4S/c1-2-21-7-3-4-15(21)13-20-18(23)14-5-6-16(19)17(12-14)27(24,25)22-8-10-26-11-9-22/h5-6,12,15H,2-4,7-11,13H2,1H3,(H,20,23)/p+1/t15-/m1/s1