2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl N-tert-butylcarbamate

Systemtic Name: 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl N-tert-butylcarbamate Openeye Name: 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)ethyl N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid 2-(4-nitro-1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(4-nitro-1,3-dioxoisoindol-2-yl)ethyl N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid 2-(1,3-diketo-4-nitro-isoindolin-2-yl)ethyl ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OCCN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)OCCN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6/c1-15(2,3)16-14(21)24-8-7-17-12(19)9-5-4-6-10(18(22)23)11(9)13(17)20/h4-6H,7-8H2,1-3H3,(H,16,21)