(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-nitrophenyl)ethanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-nitrophenyl)ethanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-nitrophenyl)acetate CAS Name: 2-(4-nitrophenyl)acetic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-(4-nitrophenyl)acetate Traditional Name: 2-(4-nitrophenyl)acetic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C)C(C)(C)C

InChI

InChI=1S/C21H25NO4/c1-14-10-17(21(3,4)5)11-15(2)19(14)13-26-20(23)12-16-6-8-18(9-7-16)22(24)25/h6-11H,12-13H2,1-5H3