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

Systemtic Name: pentyl 5-[2,4-bis(chloranyl)phenoxy]-2-nitro-benzoate Openeye Name: pentyl 5-(2,4-dichlorophenoxy)-2-nitro-benzoate CAS Name: 5-(2,4-dichlorophenoxy)-2-nitrobenzoic acid pentyl ester IUPAC Name: pentyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate Traditional Name: 5-(2,4-dichlorophenoxy)-2-nitro-benzoic acid amyl ester Formula: C18H17Cl2NO5 MolecularWeight: 398.23728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17Cl2NO5/c1-2-3-4-9-25-18(22)14-11-13(6-7-16(14)21(23)24)26-17-8-5-12(19)10-15(17)20/h5-8,10-11H,2-4,9H2,1H3