6-[(4-ethoxyphenyl)methyl-methyl-amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[(4-ethoxyphenyl)methyl-methyl-amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[(4-ethoxyphenyl)methyl-methyl-amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[(4-ethoxyphenyl)methyl-methylamino]-N-ethyl-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[(4-ethoxyphenyl)methyl-methylamino]-N-ethyl-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[(4-ethoxybenzyl)-methyl-amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CC=C(C=C3)OCC

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CC=C(C=C3)OCC

InChI

InChI=1S/C23H27N3O3S/c1-4-26(20-9-7-6-8-10-20)30(27,28)22-15-16-23(24-17-22)25(3)18-19-11-13-21(14-12-19)29-5-2/h6-17H,4-5,18H2,1-3H3/p+1