O2-methyl O1-(phenylmethyl) 4-(4-nitrophenyl)sulfonylpiperazine-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-(phenylmethyl) 4-(4-nitrophenyl)sulfonylpiperazine-1,2-dicarboxylate Openeye Name: O1-benzyl O2-methyl 4-(4-nitrophenyl)sulfonylpiperazine-1,2-dicarboxylate CAS Name: 4-(4-nitrophenyl)sulfonylpiperazine-1,2-dicarboxylic acid O2-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-methyl 4-(4-nitrophenyl)sulfonylpiperazine-1,2-dicarboxylate Traditional Name: 4-nosylpiperazine-1,2-dicarboxylic acid O1-benzyl ester O2-methyl ester Formula: C20H21N3O8S MolecularWeight: 463.46104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCN1C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CN(CCN1C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O8S/c1-30-19(24)18-13-21(32(28,29)17-9-7-16(8-10-17)23(26)27)11-12-22(18)20(25)31-14-15-5-3-2-4-6-15/h2-10,18H,11-14H2,1H3