N-[1-(2-cyclobutylideneethyl)-2-propanoyl-pyrrolidin-1-ium-1-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[1-(2-cyclobutylideneethyl)-2-propanoyl-pyrrolidin-1-ium-1-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1-(2-cyclobutylideneethyl)-2-propanoyl-pyrrolidin-1-ium-1-yl]-4-methyl-benzenesulfonamide CAS Name: N-[1-(2-cyclobutylideneethyl)-2-(1-oxopropyl)-1-pyrrolidin-1-iumyl]-4-methylbenzenesulfonamide IUPAC Name: N-[1-(2-cyclobutylideneethyl)-2-propanoylpyrrolidin-1-ium-1-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-(2-cyclobutylideneethyl)-2-propionyl-pyrrolidin-1-ium-1-yl]-4-methyl-benzenesulfonamide Formula: C20H29N2O3S+ MolecularWeight: 377.52086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1CCC[N+]1(CC=C2CCC2)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)C1CCC[N+]1(CC=C2CCC2)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H29N2O3S/c1-3-20(23)19-8-5-14-22(19,15-13-17-6-4-7-17)21-26(24,25)18-11-9-16(2)10-12-18/h9-13,19,21H,3-8,14-15H2,1-2H3/q+1