2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethanamide

Systemtic Name: 2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethanamide Openeye Name: 2-[methyl(2-naphthylsulfonyl)amino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)acetamide CAS Name: 2-[methyl(2-naphthalenylsulfonyl)amino]-N-[3-(1-pyrrolidin-1-iumyl)propyl]acetamide IUPAC Name: 2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)acetamide Traditional Name: 2-[methyl(2-naphthylsulfonyl)amino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)acetamide Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCCC[NH+]1CCCC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CN(CC(=O)NCCC[NH+]1CCCC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H27N3O3S/c1-22(16-20(24)21-11-6-14-23-12-4-5-13-23)27(25,26)19-10-9-17-7-2-3-8-18(17)15-19/h2-3,7-10,15H,4-6,11-14,16H2,1H3,(H,21,24)/p+1