2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)acetamide Formula: C20H32N3O5S+ MolecularWeight: 426.55018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CC(OC(C2)C)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2C[C@@H](O[C@H](C2)C)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H31N3O5S/c1-4-27-18-8-7-17(11-19(18)29(25,26)23-9-5-6-10-23)21-20(24)14-22-12-15(2)28-16(3)13-22/h7-8,11,15-16H,4-6,9-10,12-14H2,1-3H3,(H,21,24)/p+1/t15-,16-/m0/s1