2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetate CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetate Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetic acid 2-phthalimidoethyl ester Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O6/c1-10-15(21(25)26)11(2)20(18-10)9-14(22)27-8-7-19-16(23)12-5-3-4-6-13(12)17(19)24/h3-6H,7-9H2,1-2H3