5-[(2,4-dichlorophenyl)amino]-2-nitro-benzoate

Systemtic Name: 5-[(2,4-dichlorophenyl)amino]-2-nitro-benzoate Openeye Name: 5-(2,4-dichloroanilino)-2-nitro-benzoate CAS Name: 5-(2,4-dichloroanilino)-2-nitrobenzoate IUPAC Name: 5-(2,4-dichloroanilino)-2-nitrobenzoate Traditional Name: 5-(2,4-dichloroanilino)-2-nitro-benzoate Formula: C13H7Cl2N2O4- MolecularWeight: 326.11168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8Cl2N2O4/c14-7-1-3-11(10(15)5-7)16-8-2-4-12(17(20)21)9(6-8)13(18)19/h1-6,16H,(H,18,19)/p-1