[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-methylsulfonylbenzoate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6S/c1-27(24,25)15-9-7-14(8-10-15)17(22)26-12-16(21)20-18(23)19-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H2,19,20,21,23)