[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)C

InChI

InChI=1S/C14H18N2O6S/c1-3-7-15-14(19)16-12(17)9-22-13(18)10-5-4-6-11(8-10)23(2,20)21/h4-6,8H,3,7,9H2,1-2H3,(H2,15,16,17,19)