4-[[5-(dihydroxyboranyl)-2-nitro-phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-(dihydroxyboranyl)-2-nitro-phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-borono-2-nitro-anilino)-4-oxo-butanoic acid CAS Name: 4-(5-borono-2-nitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(5-borono-2-nitroanilino)-4-oxobutanoic acid Traditional Name: 4-(5-borono-2-nitro-anilino)-4-keto-butyric acid Formula: C10H11BN2O7 MolecularWeight: 282.01454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11BN2O7/c14-9(3-4-10(15)16)12-7-5-6(11(17)18)1-2-8(7)13(19)20/h1-2,5,17-18H,3-4H2,(H,12,14)(H,15,16)