(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetate CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)acetic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-(4-nitro-1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C)C(C)(C)C

InChI

InChI=1S/C23H24N2O6/c1-13-9-15(23(3,4)5)10-14(2)17(13)12-31-19(26)11-24-21(27)16-7-6-8-18(25(29)30)20(16)22(24)28/h6-10H,11-12H2,1-5H3