[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-[methyl(methylsulfonyl)amino]benzoate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-[methyl(methylsulfonyl)amino]benzoate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] 2-[methyl(methylsulfonyl)amino]benzoate CAS Name: 2-[methyl(methylsulfonyl)amino]benzoic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 2-[methyl(methylsulfonyl)amino]benzoate Traditional Name: 2-[mesyl(methyl)amino]benzoic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C16H23N3O7S2 MolecularWeight: 433.49972

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C16H23N3O7S2/c1-17(27(2,22)23)14-7-5-4-6-13(14)16(21)26-12-15(20)18-8-10-19(11-9-18)28(3,24)25/h4-7H,8-12H2,1-3H3