2-[(4-carboxyphenyl)amino]-4-chloranyl-5-nitro-benzoic acid

Systemtic Name: 2-[(4-carboxyphenyl)amino]-4-chloranyl-5-nitro-benzoic acid Openeye Name: 2-(4-carboxyanilino)-4-chloro-5-nitro-benzoic acid CAS Name: 2-(4-carboxyanilino)-4-chloro-5-nitrobenzoic acid IUPAC Name: 2-(4-carboxyanilino)-4-chloro-5-nitrobenzoic acid Traditional Name: 2-(4-carboxyanilino)-4-chloro-5-nitro-benzoic acid Formula: C14H9ClN2O6 MolecularWeight: 336.68406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC2=CC(=C(C=C2C(=O)O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC2=CC(=C(C=C2C(=O)O)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H9ClN2O6/c15-10-6-11(9(14(20)21)5-12(10)17(22)23)16-8-3-1-7(2-4-8)13(18)19/h1-6,16H,(H,18,19)(H,20,21)