N-ethyl-6-[2-(1H-indol-3-yl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[2-(1H-indol-3-yl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-[2-(1H-indol-3-yl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[2-(1H-indol-3-yl)ethylamino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[2-(1H-indol-3-yl)ethylamino]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[2-(1H-indol-3-yl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C23H25N4O2S+ MolecularWeight: 421.5352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H24N4O2S/c1-2-27(19-8-4-3-5-9-19)30(28,29)20-12-13-23(26-17-20)24-15-14-18-16-25-22-11-7-6-10-21(18)22/h3-13,16-17,25H,2,14-15H2,1H3,(H,24,26)/p+1