[2-(chloranylamino)-2-methyl-propyl] pyridine-4-carboxylate; methyl hydrogen sulfate

Systemtic Name: [2-(chloranylamino)-2-methyl-propyl] pyridine-4-carboxylate; methyl hydrogen sulfate Openeye Name: [2-(chloroamino)-2-methyl-propyl] pyridine-4-carboxylate; methyl hydrogen sulfate CAS Name: 4-pyridinecarboxylic acid [2-(chloroamino)-2-methylpropyl] ester; sulfuric acid methyl ester IUPAC Name: [2-(chloroamino)-2-methylpropyl] pyridine-4-carboxylate; methyl hydrogen sulfate Traditional Name: isonicotinic acid [2-(chloroamino)-2-methyl-propyl] ester; sulfuric acid methyl ester Formula: C11H17ClN2O6S MolecularWeight: 340.78048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CC=NC=C1)NCl.COS(=O)(=O)O

Isomeric SMILES

CC(C)(COC(=O)C1=CC=NC=C1)NCl.COS(=O)(=O)O

InChI

InChI=1S/C10H13ClN2O2.CH4O4S/c1-10(2,13-11)7-15-9(14)8-3-5-12-6-4-8;1-5-6(2,3)4/h3-6,13H,7H2,1-2H3;1H3,(H,2,3,4)