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

Systemtic Name: tert-butyl 2-(3-acetyloxy-5-ethyl-4-nitro-phenyl)ethanoate Openeye Name: tert-butyl 2-(3-acetoxy-5-ethyl-4-nitro-phenyl)acetate CAS Name: 2-(3-acetyloxy-5-ethyl-4-nitrophenyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-acetyloxy-5-ethyl-4-nitrophenyl)acetate Traditional Name: 2-(3-acetoxy-5-ethyl-4-nitro-phenyl)acetic acid tert-butyl ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO6/c1-6-12-7-11(9-14(19)23-16(3,4)5)8-13(22-10(2)18)15(12)17(20)21/h7-8H,6,9H2,1-5H3