5-[(5-nitro-2-oxidanyl-phenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(5-nitro-2-oxidanyl-phenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2-hydroxy-5-nitro-anilino)-5-oxo-pentanoic acid CAS Name: 5-(2-hydroxy-5-nitroanilino)-5-oxopentanoic acid IUPAC Name: 5-(2-hydroxy-5-nitroanilino)-5-oxopentanoic acid Traditional Name: 5-(2-hydroxy-5-nitro-anilino)-5-keto-valeric acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CCCC(=O)O)O

InChI

InChI=1S/C11H12N2O6/c14-9-5-4-7(13(18)19)6-8(9)12-10(15)2-1-3-11(16)17/h4-6,14H,1-3H2,(H,12,15)(H,16,17)