diethyl 2-[(E)-2-(furan-2-yl)-1-nitro-ethenyl]-2-oxidanyl-propanedioate

Systemtic Name: diethyl 2-[(E)-2-(furan-2-yl)-1-nitro-ethenyl]-2-oxidanyl-propanedioate Openeye Name: diethyl 2-[(E)-2-(2-furyl)-1-nitro-vinyl]-2-hydroxy-propanedioate CAS Name: 2-[(E)-2-(2-furanyl)-1-nitroethenyl]-2-hydroxypropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-2-(furan-2-yl)-1-nitroethenyl]-2-hydroxypropanedioate Traditional Name: 2-[(E)-2-(2-furyl)-1-nitro-vinyl]-2-hydroxy-malonic acid diethyl ester Formula: C13H15NO8 MolecularWeight: 313.2601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=CC1=CC=CO1)[N+](=O)[O-])(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C(/C(=C\C1=CC=CO1)/[N+](=O)[O-])(C(=O)OCC)O

InChI

InChI=1S/C13H15NO8/c1-3-20-11(15)13(17,12(16)21-4-2)10(14(18)19)8-9-6-5-7-22-9/h5-8,17H,3-4H2,1-2H3/b10-8+