2-azanyl-5-[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[2-hydroxy-1-(2-nitrophenyl)-2-oxo-ethoxy]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[2-hydroxy-1-(2-nitrophenyl)-2-oxoethoxy]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[2-hydroxy-1-(2-nitrophenyl)-2-oxoethoxy]-5-oxopentanoic acid Traditional Name: 2-amino-5-[2-hydroxy-2-keto-1-(2-nitrophenyl)ethoxy]-5-keto-valeric acid Formula: C13H14N2O8 MolecularWeight: 326.25886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O8/c14-8(12(17)18)5-6-10(16)23-11(13(19)20)7-3-1-2-4-9(7)15(21)22/h1-4,8,11H,5-6,14H2,(H,17,18)(H,19,20)