3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]benzamide CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[(3-fluoro-4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]benzamide Formula: C26H29FN3O3S+ MolecularWeight: 482.590163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)F

InChI

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