2-chloranyl-5-(dimethylsulfamoyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide

Systemtic Name: 2-chloranyl-5-(dimethylsulfamoyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-chloro-5-(dimethylsulfamoyl)benzamide CAS Name: 2-chloro-5-(dimethylsulfamoyl)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-chloro-5-(dimethylsulfamoyl)benzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-chloro-5-(dimethylsulfamoyl)benzamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24ClN3O3S/c1-23(2)28(26,27)17-8-9-19(21)18(12-17)20(25)22-16-10-11-24(14-16)13-15-6-4-3-5-7-15/h3-9,12,16H,10-11,13-14H2,1-2H3,(H,22,25)/p+1/t16-/m0/s1