4-[(2-azanyl-4-nitro-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-azanyl-4-nitro-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-amino-4-nitro-anilino)-4-oxo-butanoic acid CAS Name: 4-(2-amino-4-nitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(2-amino-4-nitroanilino)-4-oxobutanoic acid Traditional Name: 4-(2-amino-4-nitro-anilino)-4-keto-butyric acid Formula: C10H11N3O5 MolecularWeight: 253.21144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O5/c11-7-5-6(13(17)18)1-2-8(7)12-9(14)3-4-10(15)16/h1-2,5H,3-4,11H2,(H,12,14)(H,15,16)