ethyl 5-acetamido-2-ethoxy-4-nitro-benzoate

Systemtic Name: ethyl 5-acetamido-2-ethoxy-4-nitro-benzoate Openeye Name: ethyl 5-acetamido-2-ethoxy-4-nitro-benzoate CAS Name: 5-acetamido-2-ethoxy-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 5-acetamido-2-ethoxy-4-nitrobenzoate Traditional Name: 5-acetamido-2-ethoxy-4-nitro-benzoic acid ethyl ester Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C(=O)OCC)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1C(=O)OCC)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O6/c1-4-20-12-7-11(15(18)19)10(14-8(3)16)6-9(12)13(17)21-5-2/h6-7H,4-5H2,1-3H3,(H,14,16)