[2-(chloranylamino)-2-methyl-propyl] pyridine-3-carboxylate; methanesulfonic acid

Systemtic Name: [2-(chloranylamino)-2-methyl-propyl] pyridine-3-carboxylate; methanesulfonic acid Openeye Name: [2-(chloroamino)-2-methyl-propyl] pyridine-3-carboxylate; methanesulfonic acid CAS Name: methanesulfonic acid; 3-pyridinecarboxylic acid [2-(chloroamino)-2-methylpropyl] ester IUPAC Name: [2-(chloroamino)-2-methylpropyl] pyridine-3-carboxylate; methanesulfonic acid Traditional Name: mesylic acid; nicotinic acid [2-(chloroamino)-2-methyl-propyl] ester Formula: C11H17ClN2O5S MolecularWeight: 324.78108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CN=CC=C1)NCl.CS(=O)(=O)O

Isomeric SMILES

CC(C)(COC(=O)C1=CN=CC=C1)NCl.CS(=O)(=O)O

InChI

InChI=1S/C10H13ClN2O2.CH4O3S/c1-10(2,13-11)7-15-9(14)8-4-3-5-12-6-8;1-5(2,3)4/h3-6,13H,7H2,1-2H3;1H3,(H,2,3,4)