2-[4-fluoranyl-3-(4-methylpiperidin-1-yl)sulfonyl-phenyl]ethylazanium

Systemtic Name: 2-[4-fluoranyl-3-(4-methylpiperidin-1-yl)sulfonyl-phenyl]ethylazanium Openeye Name: 2-[4-fluoro-3-[(4-methyl-1-piperidyl)sulfonyl]phenyl]ethylammonium CAS Name: 2-[4-fluoro-3-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]ethylammonium IUPAC Name: 2-[4-fluoro-3-(4-methylpiperidin-1-yl)sulfonylphenyl]ethylazanium Traditional Name: 2-[4-fluoro-3-(4-methylpiperidino)sulfonyl-phenyl]ethylammonium Formula: C14H22FN2O2S+ MolecularWeight: 301.400083

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)CC[NH3+])F

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)CC[NH3+])F

InChI

InChI=1S/C14H21FN2O2S/c1-11-5-8-17(9-6-11)20(18,19)14-10-12(4-7-16)2-3-13(14)15/h2-3,10-11H,4-9,16H2,1H3/p+1