4-[[3,5-bis(chloranyl)phenyl]amino]-3-nitro-benzoic acid

Systemtic Name: 4-[[3,5-bis(chloranyl)phenyl]amino]-3-nitro-benzoic acid Openeye Name: 4-(3,5-dichloroanilino)-3-nitro-benzoic acid CAS Name: 4-(3,5-dichloroanilino)-3-nitrobenzoic acid IUPAC Name: 4-(3,5-dichloroanilino)-3-nitrobenzoic acid Traditional Name: 4-(3,5-dichloroanilino)-3-nitro-benzoic acid Formula: C13H8Cl2N2O4 MolecularWeight: 327.11962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])NC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])NC2=CC(=CC(=C2)Cl)Cl

InChI

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