(4-bromanyl-2-fluoranyl-phenyl)-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide Openeye Name: (4-bromo-2-fluoro-phenyl)-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide CAS Name: (4-bromo-2-fluorophenyl)-[(4-methyl-1-piperidin-1-iumyl)sulfonyl]azanide IUPAC Name: (4-bromo-2-fluorophenyl)-(4-methylpiperidin-1-ium-1-yl)sulfonylazanide Traditional Name: (4-bromo-2-fluoro-phenyl)-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide Formula: C12H16BrFN2O2S MolecularWeight: 351.235043

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)S(=O)(=O)[N-]C2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1CC[NH+](CC1)S(=O)(=O)[N-]C2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C12H15BrFN2O2S/c1-9-4-6-16(7-5-9)19(17,18)15-12-3-2-10(13)8-11(12)14/h2-3,8-9H,4-7H2,1H3/q-1/p+1