O3-ethyl O1-(phenylmethyl) 4-methylsulfonylpiperazine-1,3-dicarboxylate

Systemtic Name: O3-ethyl O1-(phenylmethyl) 4-methylsulfonylpiperazine-1,3-dicarboxylate Openeye Name: O1-benzyl O3-ethyl 4-methylsulfonylpiperazine-1,3-dicarboxylate CAS Name: 4-methylsulfonylpiperazine-1,3-dicarboxylic acid O3-ethyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 3-O-ethyl 4-methylsulfonylpiperazine-1,3-dicarboxylate Traditional Name: 4-mesylpiperazine-1,3-dicarboxylic acid O1-benzyl ester O3-ethyl ester Formula: C16H22N2O6S MolecularWeight: 370.42068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCN1S(=O)(=O)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CN(CCN1S(=O)(=O)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O6S/c1-3-23-15(19)14-11-17(9-10-18(14)25(2,21)22)16(20)24-12-13-7-5-4-6-8-13/h4-8,14H,3,9-12H2,1-2H3