N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-4-(o-tolylsulfamoyl)benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-4-(o-tolylsulfamoyl)benzamide Formula: C25H30N3O4S+ MolecularWeight: 468.5884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CO3)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC[C@@H](C3=CC=CO3)[NH+]4CCCCC4

InChI

InChI=1S/C25H29N3O4S/c1-19-8-3-4-9-22(19)27-33(30,31)21-13-11-20(12-14-21)25(29)26-18-23(24-10-7-17-32-24)28-15-5-2-6-16-28/h3-4,7-14,17,23,27H,2,5-6,15-16,18H2,1H3,(H,26,29)/p+1/t23-/m0/s1