2-(3,5-dimethylphenoxy)ethyl 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C20H23NO7 MolecularWeight: 389.39912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCCOC2=CC(=CC(=C2)C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCCOC2=CC(=CC(=C2)C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23NO7/c1-5-26-19-11-16(17(21(23)24)12-18(19)25-4)20(22)28-7-6-27-15-9-13(2)8-14(3)10-15/h8-12H,5-7H2,1-4H3