5-[(4-nitrophenyl)methoxy]-4,5-bis(oxidanylidene)pentanoic acid

Systemtic Name: 5-[(4-nitrophenyl)methoxy]-4,5-bis(oxidanylidene)pentanoic acid Openeye Name: 5-[(4-nitrophenyl)methoxy]-4,5-dioxo-pentanoic acid CAS Name: 5-[(4-nitrophenyl)methoxy]-4,5-dioxopentanoic acid IUPAC Name: 5-[(4-nitrophenyl)methoxy]-4,5-dioxopentanoic acid Traditional Name: 4,5-diketo-5-(4-nitrobenzyl)oxy-valeric acid Formula: C12H11NO7 MolecularWeight: 281.21824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C(=O)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C(=O)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO7/c14-10(5-6-11(15)16)12(17)20-7-8-1-3-9(4-2-8)13(18)19/h1-4H,5-7H2,(H,15,16)