6-(butylamino)-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-(butylamino)-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-(butylamino)-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-(butylamino)-N-ethyl-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-(butylamino)-N-ethyl-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: 6-(butylamino)-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C17H24N3O2S+ MolecularWeight: 334.45636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=[NH+]C=C(C=C1)S(=O)(=O)N(CC)C2=CC=CC=C2

Isomeric SMILES

CCCCNC1=[NH+]C=C(C=C1)S(=O)(=O)N(CC)C2=CC=CC=C2

InChI

InChI=1S/C17H23N3O2S/c1-3-5-13-18-17-12-11-16(14-19-17)23(21,22)20(4-2)15-9-7-6-8-10-15/h6-12,14H,3-5,13H2,1-2H3,(H,18,19)/p+1