N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-4-nitro-1H-pyrazole-5-carboxamide Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C2=C(C=NN2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C2=C(C=NN2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O4/c1-7(2)9-5-10(8(3)4-12(9)19)16-14(20)13-11(18(21)22)6-15-17-13/h4-7,19H,1-3H3,(H,15,17)(H,16,20)