tert-butyl 2-(3-ethyl-4-nitro-5-oxidanyl-phenyl)ethanoate

Systemtic Name: tert-butyl 2-(3-ethyl-4-nitro-5-oxidanyl-phenyl)ethanoate Openeye Name: tert-butyl 2-(3-ethyl-5-hydroxy-4-nitro-phenyl)acetate CAS Name: 2-(3-ethyl-5-hydroxy-4-nitrophenyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-ethyl-5-hydroxy-4-nitrophenyl)acetate Traditional Name: 2-(3-ethyl-5-hydroxy-4-nitro-phenyl)acetic acid tert-butyl ester Formula: C14H19NO5 MolecularWeight: 281.30436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)CC(=O)OC(C)(C)C)O)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=CC(=C1)CC(=O)OC(C)(C)C)O)[N+](=O)[O-]

InChI

InChI=1S/C14H19NO5/c1-5-10-6-9(7-11(16)13(10)15(18)19)8-12(17)20-14(2,3)4/h6-7,16H,5,8H2,1-4H3