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

Systemtic Name: 4-(dimethylcarbamoyloxy)butyl 5-[2,4-bis(chloranyl)phenoxy]-2-nitro-benzoate Openeye Name: 4-(dimethylcarbamoyloxy)butyl 5-(2,4-dichlorophenoxy)-2-nitro-benzoate CAS Name: 5-(2,4-dichlorophenoxy)-2-nitrobenzoic acid 4-[dimethylamino(oxo)methoxy]butyl ester IUPAC Name: 4-(dimethylcarbamoyloxy)butyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate Traditional Name: 5-(2,4-dichlorophenoxy)-2-nitro-benzoic acid 4-(dimethylcarbamoyloxy)butyl ester Formula: C20H20Cl2N2O7 MolecularWeight: 471.288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20Cl2N2O7/c1-23(2)20(26)30-10-4-3-9-29-19(25)15-12-14(6-7-17(15)24(27)28)31-18-8-5-13(21)11-16(18)22/h5-8,11-12H,3-4,9-10H2,1-2H3