N-ethyl-6-[(4-methylphenyl)methylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[(4-methylphenyl)methylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-N-phenyl-6-(p-tolylmethylamino)pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[(4-methylphenyl)methylamino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[(4-methylphenyl)methylamino]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[(4-methylbenzyl)amino]-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C21H24N3O2S+ MolecularWeight: 382.49916

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3=CC=C(C=C3)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3=CC=C(C=C3)C

InChI

InChI=1S/C21H23N3O2S/c1-3-24(19-7-5-4-6-8-19)27(25,26)20-13-14-21(23-16-20)22-15-18-11-9-17(2)10-12-18/h4-14,16H,3,15H2,1-2H3,(H,22,23)/p+1