2,4-bis(chloranyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-5-sulfamoyl-benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-5-sulfamoyl-benzamide Openeye Name: 2,4-dichloro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-5-sulfamoyl-benzamide CAS Name: 2,4-dichloro-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-5-sulfamoylbenzamide IUPAC Name: 2,4-dichloro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-5-sulfamoylbenzamide Traditional Name: 2,4-dichloro-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]-5-sulfamoyl-benzamide Formula: C20H24Cl2N3O3S+ MolecularWeight: 457.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=C(C=C3Cl)Cl)S(=O)(=O)N

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=C(C=C3Cl)Cl)S(=O)(=O)N

InChI

InChI=1S/C20H23Cl2N3O3S/c21-17-11-18(22)19(29(23,27)28)10-16(17)20(26)24-12-14-4-6-15(7-5-14)13-25-8-2-1-3-9-25/h4-7,10-11H,1-3,8-9,12-13H2,(H,24,26)(H2,23,27,28)/p+1