2-bromanyl-5-(cyclopropylsulfamoyl)-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzamide

Systemtic Name: 2-bromanyl-5-(cyclopropylsulfamoyl)-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzamide Openeye Name: 2-bromo-5-(cyclopropylsulfamoyl)-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzamide CAS Name: 2-bromo-5-(cyclopropylsulfamoyl)-N-[(2R)-2-(1-pyrrolidin-1-iumyl)butyl]benzamide IUPAC Name: 2-bromo-5-(cyclopropylsulfamoyl)-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzamide Traditional Name: 2-bromo-5-(cyclopropylsulfamoyl)-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzamide Formula: C18H27BrN3O3S+ MolecularWeight: 445.39428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC2CC2)Br)[NH+]3CCCC3

Isomeric SMILES

CC[C@H](CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC2CC2)Br)[NH+]3CCCC3

InChI

InChI=1S/C18H26BrN3O3S/c1-2-14(22-9-3-4-10-22)12-20-18(23)16-11-15(7-8-17(16)19)26(24,25)21-13-5-6-13/h7-8,11,13-14,21H,2-6,9-10,12H2,1H3,(H,20,23)/p+1/t14-/m1/s1