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

Systemtic Name: 6-[cyclohexyl(methyl)amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[cyclohexyl(methyl)amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[cyclohexyl(methyl)amino]-N-ethyl-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[cyclohexyl(methyl)amino]-N-ethyl-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[cyclohexyl(methyl)amino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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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)C3CCCCC3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N(C)C3CCCCC3

InChI

InChI=1S/C20H27N3O2S/c1-3-23(18-12-8-5-9-13-18)26(24,25)19-14-15-20(21-16-19)22(2)17-10-6-4-7-11-17/h5,8-9,12-17H,3-4,6-7,10-11H2,1-2H3/p+1