[2-(butylamino)-2-oxidanylidene-ethyl] 5-nitrofuran-2-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 5-nitrofuran-2-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C11H14N2O6 MolecularWeight: 270.23866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC=C(O1)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC=C(O1)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O6/c1-2-3-6-12-9(14)7-18-11(15)8-4-5-10(19-8)13(16)17/h4-5H,2-3,6-7H2,1H3,(H,12,14)