5-bromanyl-2-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Openeye Name: 5-bromo-2-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide CAS Name: 5-bromo-2-ethoxy-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzenesulfonamide IUPAC Name: 5-bromo-2-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Traditional Name: 5-bromo-2-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Formula: C14H22BrN2O3S+ MolecularWeight: 378.30508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NCC[NH+]2CCCC2

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NCC[NH+]2CCCC2

InChI

InChI=1S/C14H21BrN2O3S/c1-2-20-13-6-5-12(15)11-14(13)21(18,19)16-7-10-17-8-3-4-9-17/h5-6,11,16H,2-4,7-10H2,1H3/p+1