2-azanylidene-5-[1-(3-nitrodibenzofuran-2-yl)-2-oxidanyl-2-oxidanylidene-ethoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanylidene-5-[1-(3-nitrodibenzofuran-2-yl)-2-oxidanyl-2-oxidanylidene-ethoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-hydroxy-1-(3-nitrodibenzofuran-2-yl)-2-oxo-ethoxy]-2-imino-5-oxo-pentanoic acid CAS Name: 5-[2-hydroxy-1-(3-nitro-2-dibenzofuranyl)-2-oxoethoxy]-2-imino-5-oxopentanoic acid IUPAC Name: 5-[2-hydroxy-1-(3-nitrodibenzofuran-2-yl)-2-oxoethoxy]-2-imino-5-oxopentanoic acid Traditional Name: 5-[2-hydroxy-2-keto-1-(3-nitrodibenzofuran-2-yl)ethoxy]-2-imino-5-keto-valeric acid Formula: C19H14N2O9 MolecularWeight: 414.32246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC(=C(C=C3O2)[N+](=O)[O-])C(C(=O)O)OC(=O)CCC(=N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC(=C(C=C3O2)[N+](=O)[O-])C(C(=O)O)OC(=O)CCC(=N)C(=O)O

InChI

InChI=1S/C19H14N2O9/c20-12(18(23)24)5-6-16(22)30-17(19(25)26)11-7-10-9-3-1-2-4-14(9)29-15(10)8-13(11)21(27)28/h1-4,7-8,17,20H,5-6H2,(H,23,24)(H,25,26)