2-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(5-methylisoxazol-3-yl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(5-methyl-3-isoxazolyl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(5-methylisoxazol-3-yl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C13H9N3O5 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O5/c1-7-4-8(14-21-7)6-15-12(17)10-3-2-9(16(19)20)5-11(10)13(15)18/h2-5H,6H2,1H3