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

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Openeye Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]benzamide IUPAC Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Traditional Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Formula: C26H35FN3O3S+ MolecularWeight: 488.637803

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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)NCC3(CCCCC3)[NH+]4CCCCC4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC3(CCCCC3)[NH+]4CCCCC4)F

InChI

InChI=1S/C26H34FN3O3S/c1-20-11-12-23(18-24(20)27)34(32,33)29-22-10-8-9-21(17-22)25(31)28-19-26(13-4-2-5-14-26)30-15-6-3-7-16-30/h8-12,17-18,29H,2-7,13-16,19H2,1H3,(H,28,31)/p+1