3-(naphthalen-2-ylsulfonylamino)-N-(3-piperidin-1-ium-1-ylpropyl)propanamide

Systemtic Name: 3-(naphthalen-2-ylsulfonylamino)-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Openeye Name: 3-(2-naphthylsulfonylamino)-N-(3-piperidin-1-ium-1-ylpropyl)propanamide CAS Name: 3-(2-naphthalenylsulfonylamino)-N-[3-(1-piperidin-1-iumyl)propyl]propanamide IUPAC Name: 3-(naphthalen-2-ylsulfonylamino)-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Traditional Name: 3-(2-naphthylsulfonylamino)-N-(3-piperidin-1-ium-1-ylpropyl)propionamide Formula: C21H30N3O3S+ MolecularWeight: 404.5462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H29N3O3S/c25-21(22-12-6-16-24-14-4-1-5-15-24)11-13-23-28(26,27)20-10-9-18-7-2-3-8-19(18)17-20/h2-3,7-10,17,23H,1,4-6,11-16H2,(H,22,25)/p+1