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

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-morpholinosulfonyl-benzamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-morpholinosulfonyl-benzamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O4S/c1-2-20-9-3-4-16(20)14-19-18(22)15-5-7-17(8-6-15)26(23,24)21-10-12-25-13-11-21/h5-8,16H,2-4,9-14H2,1H3,(H,19,22)/p+1/t16-/m1/s1