2-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]quinolin-1-ium

Systemtic Name: 2-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]quinolin-1-ium Openeye Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]quinolin-1-ium CAS Name: 2-[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]quinolin-1-ium IUPAC Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]quinolin-1-ium Traditional Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazino]quinolin-1-ium Formula: C19H18F2N3O2S+ MolecularWeight: 390.426926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C3=CC=CC=C3C=C2)S(=O)(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

C1CN(CCN1C2=[NH+]C3=CC=CC=C3C=C2)S(=O)(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C19H17F2N3O2S/c20-15-5-3-6-16(21)19(15)27(25,26)24-12-10-23(11-13-24)18-9-8-14-4-1-2-7-17(14)22-18/h1-9H,10-13H2/p+1