methyl 6-(4-methylsulfonylpiperazin-1-yl)pyridine-3-carboxylate

Systemtic Name: methyl 6-(4-methylsulfonylpiperazin-1-yl)pyridine-3-carboxylate Openeye Name: methyl 6-(4-methylsulfonylpiperazin-1-yl)pyridine-3-carboxylate CAS Name: 6-(4-methylsulfonyl-1-piperazinyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-methylsulfonylpiperazin-1-yl)pyridine-3-carboxylate Traditional Name: 6-(4-mesylpiperazino)nicotinic acid methyl ester Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C12H17N3O4S/c1-19-12(16)10-3-4-11(13-9-10)14-5-7-15(8-6-14)20(2,17)18/h3-4,9H,5-8H2,1-2H3