methyl 4-[[4-(phenylsulfonyl)piperazin-1-yl]sulfonylmethyl]benzoate

Systemtic Name: methyl 4-[[4-(phenylsulfonyl)piperazin-1-yl]sulfonylmethyl]benzoate Openeye Name: methyl 4-[[4-(benzenesulfonyl)piperazin-1-yl]sulfonylmethyl]benzoate CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]sulfonylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(benzenesulfonyl)piperazin-1-yl]sulfonylmethyl]benzoate Traditional Name: 4-[(4-besylpiperazino)sulfonylmethyl]benzoic acid methyl ester Formula: C19H22N2O6S2 MolecularWeight: 438.51778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6S2/c1-27-19(22)17-9-7-16(8-10-17)15-28(23,24)20-11-13-21(14-12-20)29(25,26)18-5-3-2-4-6-18/h2-10H,11-15H2,1H3