N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-methyl-5-[(3-methylphenyl)sulfamoyl]benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-methyl-5-[(3-methylphenyl)sulfamoyl]benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-methyl-5-(m-tolylsulfamoyl)benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2-methyl-5-[(3-methylphenyl)sulfamoyl]benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-2-methyl-5-[(3-methylphenyl)sulfamoyl]benzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-methyl-5-(m-tolylsulfamoyl)benzamide Formula: C26H32N3O4S+ MolecularWeight: 482.61498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCC(C3=CC=CO3)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NC[C@@H](C3=CC=CO3)[NH+]4CCCCC4

InChI

InChI=1S/C26H31N3O4S/c1-19-8-6-9-21(16-19)28-34(31,32)22-12-11-20(2)23(17-22)26(30)27-18-24(25-10-7-15-33-25)29-13-4-3-5-14-29/h6-12,15-17,24,28H,3-5,13-14,18H2,1-2H3,(H,27,30)/p+1/t24-/m0/s1