N-(5-methyl-2-pyridin-2-yl-pyrazol-3-yl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(5-methyl-2-pyridin-2-yl-pyrazol-3-yl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-[5-methyl-2-(2-pyridyl)pyrazol-3-yl]-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-[5-methyl-2-(2-pyridinyl)-3-pyrazolyl]-3-(4-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)-3-(4-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: 3-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-[5-methyl-2-(2-pyridyl)pyrazol-3-yl]propionamide Formula: C20H16N6O5 MolecularWeight: 420.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CC=CC=N4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CC=CC=N4

InChI

InChI=1S/C20H16N6O5/c1-12-11-16(25(23-12)15-7-2-3-9-21-15)22-17(27)8-10-24-19(28)13-5-4-6-14(26(30)31)18(13)20(24)29/h2-7,9,11H,8,10H2,1H3,(H,22,27)