[2-(dimethylamino)pyridin-1-ium-4-yl]methyl-(3-methoxycarbonylphenyl)sulfonyl-azanide

Systemtic Name: [2-(dimethylamino)pyridin-1-ium-4-yl]methyl-(3-methoxycarbonylphenyl)sulfonyl-azanide Openeye Name: [2-(dimethylamino)pyridin-1-ium-4-yl]methyl-(3-methoxycarbonylphenyl)sulfonyl-azanide CAS Name: [2-(dimethylamino)-4-pyridin-1-iumyl]methyl-(3-methoxycarbonylphenyl)sulfonylazanide IUPAC Name: [2-(dimethylamino)pyridin-1-ium-4-yl]methyl-(3-methoxycarbonylphenyl)sulfonylazanide Traditional Name: (3-carbomethoxyphenyl)sulfonyl-[[2-(dimethylamino)pyridin-1-ium-4-yl]methyl]azanide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=[NH+]C=CC(=C1)C[N-]S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CN(C)C1=[NH+]C=CC(=C1)C[N-]S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H18N3O4S/c1-19(2)15-9-12(7-8-17-15)11-18-24(21,22)14-6-4-5-13(10-14)16(20)23-3/h4-10H,11H2,1-3H3/q-1/p+1