pentyl 2-nitro-5-[2,4,6-tris(chloranyl)phenoxy]benzoate

Systemtic Name: pentyl 2-nitro-5-[2,4,6-tris(chloranyl)phenoxy]benzoate Openeye Name: pentyl 2-nitro-5-(2,4,6-trichlorophenoxy)benzoate CAS Name: 2-nitro-5-(2,4,6-trichlorophenoxy)benzoic acid pentyl ester IUPAC Name: pentyl 2-nitro-5-(2,4,6-trichlorophenoxy)benzoate Traditional Name: 2-nitro-5-(2,4,6-trichlorophenoxy)benzoic acid amyl ester Formula: C18H16Cl3NO5 MolecularWeight: 432.68234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16Cl3NO5/c1-2-3-4-7-26-18(23)13-10-12(5-6-16(13)22(24)25)27-17-14(20)8-11(19)9-15(17)21/h5-6,8-10H,2-4,7H2,1H3