1-[(4-methylphenyl)sulfonylamino]pyridin-1-ium-3-carboximidate

Systemtic Name: 1-[(4-methylphenyl)sulfonylamino]pyridin-1-ium-3-carboximidate Openeye Name: 1-(p-tolylsulfonylamino)pyridin-1-ium-3-carboximidate CAS Name: 1-[(4-methylphenyl)sulfonylamino]-3-pyridin-1-iumcarboximidate IUPAC Name: 1-[(4-methylphenyl)sulfonylamino]pyridin-1-ium-3-carboximidate Traditional Name: 1-(tosylamino)pyridin-1-ium-3-carboximidate Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N[N+]2=CC=CC(=C2)C(=N)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[N+]2=CC=CC(=C2)C(=N)[O-]

InChI

InChI=1S/C13H13N3O3S/c1-10-4-6-12(7-5-10)20(18,19)15-16-8-2-3-11(9-16)13(14)17/h2-9,15H,1H3,(H-,14,17)