3-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Formula: C26H32N3O4S+ MolecularWeight: 482.61498

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(C3=CC=CO3)[NH+]4CCCCC4

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC[C@@H](C3=CC=CO3)[NH+]4CCCCC4

InChI

InChI=1S/C26H31N3O4S/c1-2-29(22-12-5-3-6-13-22)34(31,32)23-14-9-11-21(19-23)26(30)27-20-24(25-15-10-18-33-25)28-16-7-4-8-17-28/h3,5-6,9-15,18-19,24H,2,4,7-8,16-17,20H2,1H3,(H,27,30)/p+1/t24-/m0/s1