ethyl 2,2-dimethyl-3-(4-nitrothiophen-2-yl)propanoate

Systemtic Name: ethyl 2,2-dimethyl-3-(4-nitrothiophen-2-yl)propanoate Openeye Name: ethyl 2,2-dimethyl-3-(4-nitro-2-thienyl)propanoate CAS Name: 2,2-dimethyl-3-(4-nitro-2-thiophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-3-(4-nitrothiophen-2-yl)propanoate Traditional Name: 2,2-dimethyl-3-(4-nitro-2-thienyl)propionic acid ethyl ester Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CC1=CC(=CS1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)(C)CC1=CC(=CS1)[N+](=O)[O-]

InChI

InChI=1S/C11H15NO4S/c1-4-16-10(13)11(2,3)6-9-5-8(7-17-9)12(14)15/h5,7H,4,6H2,1-3H3