2-chloranyl-5-[ethyl(phenyl)sulfamoyl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide

Systemtic Name: 2-chloranyl-5-[ethyl(phenyl)sulfamoyl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-chloro-5-[ethyl(phenyl)sulfamoyl]benzamide CAS Name: 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-chloro-5-[ethyl(phenyl)sulfamoyl]benzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-chloro-5-[ethyl(phenyl)sulfamoyl]benzamide Formula: C27H31ClN3O3S+ MolecularWeight: 513.07134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H30ClN3O3S/c1-2-31(23-11-7-4-8-12-23)35(33,34)24-13-14-26(28)25(19-24)27(32)29-22-15-17-30(18-16-22)20-21-9-5-3-6-10-21/h3-14,19,22H,2,15-18,20H2,1H3,(H,29,32)/p+1