2-[2-(2,6-dimethylphenoxy)ethyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[2-(2,6-dimethylphenoxy)ethyl]-4-nitro-isoindoline-1,3-quinone Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5/c1-11-5-3-6-12(2)16(11)25-10-9-19-17(21)13-7-4-8-14(20(23)24)15(13)18(19)22/h3-8H,9-10H2,1-2H3