N-(3-methyl-1,2-oxazol-5-yl)-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(3-methylisoxazol-5-yl)-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-(5-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(3-methyl-1,2-oxazol-5-yl)-2-(5-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: 2-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-(3-methylisoxazol-5-yl)acetamide Formula: C14H10N4O6 MolecularWeight: 330.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O6/c1-7-4-12(24-16-7)15-11(19)6-17-13(20)9-3-2-8(18(22)23)5-10(9)14(17)21/h2-5H,6H2,1H3,(H,15,19)