ethyl 4-ethyl-3-nitro-benzoate

Systemtic Name: ethyl 4-ethyl-3-nitro-benzoate Openeye Name: ethyl 4-ethyl-3-nitro-benzoate CAS Name: 4-ethyl-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-ethyl-3-nitrobenzoate Traditional Name: 4-ethyl-3-nitro-benzoic acid ethyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO4/c1-3-8-5-6-9(11(13)16-4-2)7-10(8)12(14)15/h5-7H,3-4H2,1-2H3