[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoate Openeye Name: (2-oxo-2-ureido-ethyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butyric acid (2-keto-2-ureido-ethyl) ester Formula: C16H21N3O8S MolecularWeight: 415.41824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC(=O)N)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)NC(=O)N)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C16H21N3O8S/c1-9(2)14(15(21)27-8-13(20)18-16(17)22)19-28(23,24)10-3-4-11-12(7-10)26-6-5-25-11/h3-4,7,9,14,19H,5-6,8H2,1-2H3,(H3,17,18,20,22)