N-ethyl-6-[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[[(2S)-2-hydroxy-2-phenylethyl]amino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[[(2S)-2-hydroxy-2-phenylethyl]amino]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C21H24N3O3S+ MolecularWeight: 398.49856

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCC(C3=CC=CC=C3)O

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NC[C@H](C3=CC=CC=C3)O

InChI

InChI=1S/C21H23N3O3S/c1-2-24(18-11-7-4-8-12-18)28(26,27)19-13-14-21(22-15-19)23-16-20(25)17-9-5-3-6-10-17/h3-15,20,25H,2,16H2,1H3,(H,22,23)/p+1/t20-/m1/s1