[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H17ClN2O6S MolecularWeight: 424.85538

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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=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H17ClN2O6S/c1-28(25,26)13-7-8-15(19)14(9-13)17(23)27-11-16(22)21-18(24)20-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H2,20,21,22,24)