O3-methyl O1-(phenylmethyl) 4-(4-methoxyphenyl)sulfonylpiperazine-1,3-dicarboxylate

Systemtic Name: O3-methyl O1-(phenylmethyl) 4-(4-methoxyphenyl)sulfonylpiperazine-1,3-dicarboxylate Openeye Name: O1-benzyl O3-methyl 4-(4-methoxyphenyl)sulfonylpiperazine-1,3-dicarboxylate CAS Name: 4-(4-methoxyphenyl)sulfonylpiperazine-1,3-dicarboxylic acid O3-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 3-O-methyl 4-(4-methoxyphenyl)sulfonylpiperazine-1,3-dicarboxylate Traditional Name: 4-(4-methoxyphenyl)sulfonylpiperazine-1,3-dicarboxylic acid O1-benzyl ester O3-methyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)OC)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)OC)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O7S/c1-28-17-8-10-18(11-9-17)31(26,27)23-13-12-22(14-19(23)20(24)29-2)21(25)30-15-16-6-4-3-5-7-16/h3-11,19H,12-15H2,1-2H3