ethyl 2-(2,4-dimethylphenyl)-2-nitro-propanoate

Systemtic Name: ethyl 2-(2,4-dimethylphenyl)-2-nitro-propanoate Openeye Name: ethyl 2-(2,4-dimethylphenyl)-2-nitro-propanoate CAS Name: 2-(2,4-dimethylphenyl)-2-nitropropanoic acid ethyl ester IUPAC Name: ethyl 2-(2,4-dimethylphenyl)-2-nitropropanoate Traditional Name: 2-(2,4-dimethylphenyl)-2-nitro-propionic acid ethyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-5-18-12(15)13(4,14(16)17)11-7-6-9(2)8-10(11)3/h6-8H,5H2,1-4H3