(2R)-N-[(4-methylphenyl)sulfonylmethyl]-2-morpholin-4-ium-4-yl-2-phenyl-ethanamide

Systemtic Name: (2R)-N-[(4-methylphenyl)sulfonylmethyl]-2-morpholin-4-ium-4-yl-2-phenyl-ethanamide Openeye Name: (2R)-2-morpholin-4-ium-4-yl-2-phenyl-N-(p-tolylsulfonylmethyl)acetamide CAS Name: (2R)-N-[(4-methylphenyl)sulfonylmethyl]-2-(4-morpholin-4-iumyl)-2-phenylacetamide IUPAC Name: (2R)-N-[(4-methylphenyl)sulfonylmethyl]-2-morpholin-4-ium-4-yl-2-phenylacetamide Traditional Name: (2R)-2-morpholin-4-ium-4-yl-2-phenyl-N-(tosylmethyl)acetamide Formula: C20H25N2O4S+ MolecularWeight: 389.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)C(C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C20H24N2O4S/c1-16-7-9-18(10-8-16)27(24,25)15-21-20(23)19(17-5-3-2-4-6-17)22-11-13-26-14-12-22/h2-10,19H,11-15H2,1H3,(H,21,23)/p+1/t19-/m1/s1