(2,6-dimethylphenyl) 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: (2,6-dimethylphenyl) 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: (2,6-dimethylphenyl) 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid (2,6-dimethylphenyl) ester Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OC2=C(C=CC=C2C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OC2=C(C=CC=C2C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19NO6/c1-5-24-16-9-13(14(19(21)22)10-15(16)23-4)18(20)25-17-11(2)7-6-8-12(17)3/h6-10H,5H2,1-4H3