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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O8/c1-2-23-11(18)7-3-8(5-9(4-7)16(21)22)12(19)24-6-10(17)15-13(14)20/h3-5H,2,6H2,1H3,(H3,14,15,17,20)