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

Systemtic Name: methyl 4-chloranyl-3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]sulfonyl-benzoate Openeye Name: methyl 4-chloro-3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]sulfonyl-benzoate CAS Name: 4-chloro-3-[[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]sulfonylbenzoate Traditional Name: 4-chloro-3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]sulfonyl-benzoic acid methyl ester Formula: C16H16Cl2N2O6S3 MolecularWeight: 499.40904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H16Cl2N2O6S3/c1-26-16(21)11-2-3-12(17)13(10-11)28(22,23)19-6-8-20(9-7-19)29(24,25)15-5-4-14(18)27-15/h2-5,10H,6-9H2,1H3