ethyl 3-(4-nitrophenyl)-3-oxidanyl-butanoate

Systemtic Name: ethyl 3-(4-nitrophenyl)-3-oxidanyl-butanoate Openeye Name: ethyl 3-hydroxy-3-(4-nitrophenyl)butanoate CAS Name: 3-hydroxy-3-(4-nitrophenyl)butanoic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-3-(4-nitrophenyl)butanoate Traditional Name: 3-hydroxy-3-(4-nitrophenyl)butyric acid ethyl ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5/c1-3-18-11(14)8-12(2,15)9-4-6-10(7-5-9)13(16)17/h4-7,15H,3,8H2,1-2H3