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

Systemtic Name: N-ethyl-6-(3-oxidanylpropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-(3-hydroxypropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-(3-hydroxypropylamino)-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-(3-hydroxypropylamino)-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-(3-hydroxypropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C16H22N3O3S+ MolecularWeight: 336.42918

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCCO

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCCO

InChI

InChI=1S/C16H21N3O3S/c1-2-19(14-7-4-3-5-8-14)23(21,22)15-9-10-16(18-13-15)17-11-6-12-20/h3-5,7-10,13,20H,2,6,11-12H2,1H3,(H,17,18)/p+1