N,N-diethyl-4-[(6-fluoranyl-2-methyl-quinolin-1-ium-4-yl)amino]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(6-fluoranyl-2-methyl-quinolin-1-ium-4-yl)amino]benzenesulfonamide Openeye Name: N,N-diethyl-4-[(6-fluoro-2-methyl-quinolin-1-ium-4-yl)amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[(6-fluoro-2-methyl-4-quinolin-1-iumyl)amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[(6-fluoro-2-methylquinolin-1-ium-4-yl)amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[(6-fluoro-2-methyl-quinolin-1-ium-4-yl)amino]benzenesulfonamide Formula: C20H23FN3O2S+ MolecularWeight: 388.478923

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=CC(=[NH+]C3=C2C=C(C=C3)F)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=CC(=[NH+]C3=C2C=C(C=C3)F)C

InChI

InChI=1S/C20H22FN3O2S/c1-4-24(5-2)27(25,26)17-9-7-16(8-10-17)23-20-12-14(3)22-19-11-6-15(21)13-18(19)20/h6-13H,4-5H2,1-3H3,(H,22,23)/p+1