(4-bromanyl-2-chloranyl-phenyl)sulfonyl-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]azanide

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl)sulfonyl-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]azanide Openeye Name: (4-bromo-2-chloro-phenyl)sulfonyl-[(6-morpholinopyridin-1-ium-3-yl)methyl]azanide CAS Name: (4-bromo-2-chlorophenyl)sulfonyl-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]azanide IUPAC Name: (4-bromo-2-chlorophenyl)sulfonyl-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]azanide Traditional Name: (4-bromo-2-chloro-phenyl)sulfonyl-[(6-morpholinopyridin-1-ium-3-yl)methyl]azanide Formula: C16H17BrClN3O3S MolecularWeight: 446.74648

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)C[N-]S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)C[N-]S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C16H16BrClN3O3S/c17-13-2-3-15(14(18)9-13)25(22,23)20-11-12-1-4-16(19-10-12)21-5-7-24-8-6-21/h1-4,9-10H,5-8,11H2/q-1/p+1