4-[4-[2,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-7-chloranyl-quinolin-1-ium

Systemtic Name: 4-[4-[2,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-7-chloranyl-quinolin-1-ium Openeye Name: 7-chloro-4-[4-(2,4-difluorophenyl)sulfonylpiperazin-1-yl]quinolin-1-ium CAS Name: 7-chloro-4-[4-(2,4-difluorophenyl)sulfonyl-1-piperazinyl]quinolin-1-ium IUPAC Name: 7-chloro-4-[4-(2,4-difluorophenyl)sulfonylpiperazin-1-yl]quinolin-1-ium Traditional Name: 7-chloro-4-[4-(2,4-difluorophenyl)sulfonylpiperazino]quinolin-1-ium Formula: C19H17ClF2N3O2S+ MolecularWeight: 424.871986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CC(=CC3=[NH+]C=C2)Cl)S(=O)(=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1C2=C3C=CC(=CC3=[NH+]C=C2)Cl)S(=O)(=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C19H16ClF2N3O2S/c20-13-1-3-15-17(11-13)23-6-5-18(15)24-7-9-25(10-8-24)28(26,27)19-4-2-14(21)12-16(19)22/h1-6,11-12H,7-10H2/p+1