O3-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-(1-methyl-2-oxo-2-ureido-ethyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[1-(carbamoylamino)-1-oxopropan-2-yl] ester O1-methyl ester IUPAC Name: 3-O-[1-(carbamoylamino)-1-oxopropan-2-yl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-keto-1-methyl-2-ureido-ethyl) ester O1-methyl ester Formula: C13H13N3O8 MolecularWeight: 339.25762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C1=CC(=CC(=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC(=O)N)OC(=O)C1=CC(=CC(=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O8/c1-6(10(17)15-13(14)20)24-12(19)8-3-7(11(18)23-2)4-9(5-8)16(21)22/h3-6H,1-2H3,(H3,14,15,17,20)