2-[2,4-bis(chloranyl)phenoxy]-5-chloranyl-phenol; 4-nitrobenzoic acid

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-5-chloranyl-phenol; 4-nitrobenzoic acid Openeye Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol; 4-nitrobenzoic acid CAS Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol; 4-nitrobenzoic acid IUPAC Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol; 4-nitrobenzoic acid Traditional Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol; 4-nitrobenzoic acid Formula: C19H12Cl3NO6 MolecularWeight: 456.66068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)[N+](=O)[O-].C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)[N+](=O)[O-].C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H7Cl3O2.C7H5NO4/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16;9-7(10)5-1-3-6(4-2-5)8(11)12/h1-6,16H;1-4H,(H,9,10)