N-(5-methyl-2-propan-2-yl-pyrazol-3-yl)-4-nitro-benzamide

Systemtic Name: N-(5-methyl-2-propan-2-yl-pyrazol-3-yl)-4-nitro-benzamide Openeye Name: N-(2-isopropyl-5-methyl-pyrazol-3-yl)-4-nitro-benzamide CAS Name: N-(5-methyl-2-propan-2-yl-3-pyrazolyl)-4-nitrobenzamide IUPAC Name: N-(5-methyl-2-propan-2-ylpyrazol-3-yl)-4-nitrobenzamide Traditional Name: N-(2-isopropyl-5-methyl-pyrazol-3-yl)-4-nitro-benzamide Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O3/c1-9(2)17-13(8-10(3)16-17)15-14(19)11-4-6-12(7-5-11)18(20)21/h4-9H,1-3H3,(H,15,19)