2-[(4-fluoranyl-2-methyl-phenyl)sulfonylamino]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide

Systemtic Name: 2-[(4-fluoranyl-2-methyl-phenyl)sulfonylamino]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[(4-fluoro-2-methyl-phenyl)sulfonylamino]benzamide CAS Name: 2-[(4-fluoro-2-methylphenyl)sulfonylamino]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[(4-fluoro-2-methylphenyl)sulfonylamino]benzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[(4-fluoro-2-methyl-phenyl)sulfonylamino]benzamide Formula: C26H29FN3O3S+ MolecularWeight: 482.590163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28FN3O3S/c1-19-17-21(27)11-12-25(19)34(32,33)29-24-10-6-5-9-23(24)26(31)28-22-13-15-30(16-14-22)18-20-7-3-2-4-8-20/h2-12,17,22,29H,13-16,18H2,1H3,(H,28,31)/p+1