2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(2R,6R)-2,6-dimethyl-4-morpholin-4-iumyl]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C[C@@H]1C[NH+](C[C@H](O1)C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H27N3O4S/c1-14-11-20(12-15(2)25-14)13-18(22)19-16-6-5-7-17(10-16)26(23,24)21-8-3-4-9-21/h5-7,10,14-15H,3-4,8-9,11-13H2,1-2H3,(H,19,22)/p+1/t14-,15-/m1/s1