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

Systemtic Name: 4-[(2-chloranyl-5-nitro-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-chloro-5-nitro-anilino)-4-oxo-butanoic acid CAS Name: 4-(2-chloro-5-nitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(2-chloro-5-nitroanilino)-4-oxobutanoic acid Traditional Name: 4-(2-chloro-5-nitro-anilino)-4-keto-butyric acid Formula: C10H9ClN2O5 MolecularWeight: 272.64186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9ClN2O5/c11-7-2-1-6(13(17)18)5-8(7)12-9(14)3-4-10(15)16/h1-2,5H,3-4H2,(H,12,14)(H,15,16)