methyl 2-chloranyl-5-[4-(4-chloranyl-3-methoxycarbonyl-phenyl)sulfonylpiperazin-1-yl]sulfonyl-benzoate

Systemtic Name: methyl 2-chloranyl-5-[4-(4-chloranyl-3-methoxycarbonyl-phenyl)sulfonylpiperazin-1-yl]sulfonyl-benzoate Openeye Name: methyl 2-chloro-5-[4-(4-chloro-3-methoxycarbonyl-phenyl)sulfonylpiperazin-1-yl]sulfonyl-benzoate CAS Name: 2-chloro-5-[[4-(4-chloro-3-methoxycarbonylphenyl)sulfonyl-1-piperazinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[4-(4-chloro-3-methoxycarbonylphenyl)sulfonylpiperazin-1-yl]sulfonylbenzoate Traditional Name: 5-[4-(3-carbomethoxy-4-chloro-phenyl)sulfonylpiperazino]sulfonyl-2-chloro-benzoic acid methyl ester Formula: C20H20Cl2N2O8S2 MolecularWeight: 551.4174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OC)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OC)Cl

InChI

InChI=1S/C20H20Cl2N2O8S2/c1-31-19(25)15-11-13(3-5-17(15)21)33(27,28)23-7-9-24(10-8-23)34(29,30)14-4-6-18(22)16(12-14)20(26)32-2/h3-6,11-12H,7-10H2,1-2H3