3-(4-chlorophenyl)sulfonyl-6-fluoranyl-4-[(3R)-3-methylpiperidin-1-yl]quinolin-1-ium

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-6-fluoranyl-4-[(3R)-3-methylpiperidin-1-yl]quinolin-1-ium Openeye Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-[(3R)-3-methyl-1-piperidyl]quinolin-1-ium CAS Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-[(3R)-3-methyl-1-piperidinyl]quinolin-1-ium IUPAC Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-[(3R)-3-methylpiperidin-1-yl]quinolin-1-ium Traditional Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-[(3R)-3-methylpiperidino]quinolin-1-ium Formula: C21H21ClFN2O2S+ MolecularWeight: 419.920043

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C3C=C(C=CC3=[NH+]C=C2S(=O)(=O)C4=CC=C(C=C4)Cl)F

Isomeric SMILES

C[C@@H]1CCCN(C1)C2=C3C=C(C=CC3=[NH+]C=C2S(=O)(=O)C4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C21H20ClFN2O2S/c1-14-3-2-10-25(13-14)21-18-11-16(23)6-9-19(18)24-12-20(21)28(26,27)17-7-4-15(22)5-8-17/h4-9,11-12,14H,2-3,10,13H2,1H3/p+1/t14-/m1/s1