4-[6-[4-(7-chloranylquinolin-4-yl)piperazin-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[4-(7-chloranylquinolin-4-yl)piperazin-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Openeye Name: 4-[6-[4-(7-chloro-4-quinolyl)piperazin-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine CAS Name: 4-[[6-[4-(7-chloro-4-quinolinyl)-1-piperazinyl]-3-pyridin-1-iumyl]sulfonyl]morpholine IUPAC Name: 4-[6-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Traditional Name: 4-[6-[4-(7-chloro-4-quinolyl)piperazino]pyridin-1-ium-3-yl]sulfonylmorpholine Formula: C22H25ClN5O3S+ MolecularWeight: 474.9836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CC(=CC3=NC=C2)Cl)C4=[NH+]C=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=C3C=CC(=CC3=NC=C2)Cl)C4=[NH+]C=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C22H24ClN5O3S/c23-17-1-3-19-20(15-17)24-6-5-21(19)26-7-9-27(10-8-26)22-4-2-18(16-25-22)32(29,30)28-11-13-31-14-12-28/h1-6,15-16H,7-14H2/p+1