methyl 4-chloranyl-3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-benzoate

Systemtic Name: methyl 4-chloranyl-3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-benzoate Openeye Name: methyl 4-chloro-3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-benzoate CAS Name: 4-chloro-3-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]sulfonylbenzoate Traditional Name: 4-chloro-3-[4-(3-chlorophenyl)sulfonylpiperazino]sulfonyl-benzoic acid methyl ester Formula: C18H18Cl2N2O6S2 MolecularWeight: 493.38132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N2O6S2/c1-28-18(23)13-5-6-16(20)17(11-13)30(26,27)22-9-7-21(8-10-22)29(24,25)15-4-2-3-14(19)12-15/h2-6,11-12H,7-10H2,1H3