[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid [2-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H15ClN2O7S MolecularWeight: 414.8175

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC(=O)NC(=O)NCC2=CC=CO2

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC(=O)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C16H15ClN2O7S/c1-27(23,24)11-4-5-13(17)12(7-11)15(21)26-9-14(20)19-16(22)18-8-10-3-2-6-25-10/h2-7H,8-9H2,1H3,(H2,18,19,20,22)