ethyl 3,4-dimethyl-5-nitro-benzoate

Systemtic Name: ethyl 3,4-dimethyl-5-nitro-benzoate Openeye Name: ethyl 3,4-dimethyl-5-nitro-benzoate CAS Name: 3,4-dimethyl-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3,4-dimethyl-5-nitrobenzoate Traditional Name: 3,4-dimethyl-5-nitro-benzoic acid ethyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)C

InChI

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