[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] quinoline-5-carboxylate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] quinoline-5-carboxylate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] quinoline-5-carboxylate CAS Name: 5-quinolinecarboxylic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] quinoline-5-carboxylate Traditional Name: quinoline-5-carboxylic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)C2=C3C=CC=NC3=CC=C2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)C2=C3C=CC=NC3=CC=C2

InChI

InChI=1S/C17H19N3O5S/c1-26(23,24)20-10-8-19(9-11-20)16(21)12-25-17(22)14-4-2-6-15-13(14)5-3-7-18-15/h2-7H,8-12H2,1H3