ethyl 2,2-dimethyl-4-nitro-3-phenyl-butanoate

Systemtic Name: ethyl 2,2-dimethyl-4-nitro-3-phenyl-butanoate Openeye Name: ethyl 2,2-dimethyl-4-nitro-3-phenyl-butanoate CAS Name: 2,2-dimethyl-4-nitro-3-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-4-nitro-3-phenylbutanoate Traditional Name: 2,2-dimethyl-4-nitro-3-phenyl-butyric acid ethyl ester Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c1-4-19-13(16)14(2,3)12(10-15(17)18)11-8-6-5-7-9-11/h5-9,12H,4,10H2,1-3H3