methyl (2R)-1-(phenylsulfonyl)-4-pyridin-3-ylcarbonyl-piperazine-2-carboxylate

Systemtic Name: methyl (2R)-1-(phenylsulfonyl)-4-pyridin-3-ylcarbonyl-piperazine-2-carboxylate Openeye Name: methyl (2R)-1-(benzenesulfonyl)-4-(pyridine-3-carbonyl)piperazine-2-carboxylate CAS Name: (2R)-1-(benzenesulfonyl)-4-[oxo(3-pyridinyl)methyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-1-(benzenesulfonyl)-4-(pyridine-3-carbonyl)piperazine-2-carboxylate Traditional Name: (2R)-1-besyl-4-nicotinoyl-piperazine-2-carboxylic acid methyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C(=O)C3=CN=CC=C3

Isomeric SMILES

COC(=O)[C@H]1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H19N3O5S/c1-26-18(23)16-13-20(17(22)14-6-5-9-19-12-14)10-11-21(16)27(24,25)15-7-3-2-4-8-15/h2-9,12,16H,10-11,13H2,1H3/t16-/m1/s1