(2R)-N-(2-morpholin-4-ium-4-ylethyl)-1-naphthalen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(2-morpholin-4-ium-4-ylethyl)-1-naphthalen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(2-morpholin-4-ium-4-ylethyl)-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-[2-(4-morpholin-4-iumyl)ethyl]-1-(2-naphthalenylsulfonyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(2-morpholin-4-ium-4-ylethyl)-1-naphthalen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-(2-morpholin-4-ium-4-ylethyl)-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

C1C[C@@H](N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C21H27N3O4S/c25-21(22-9-11-23-12-14-28-15-13-23)20-6-3-10-24(20)29(26,27)19-8-7-17-4-1-2-5-18(17)16-19/h1-2,4-5,7-8,16,20H,3,6,9-15H2,(H,22,25)/p+1/t20-/m1/s1