3-methyl-1-(4-nitrophenyl)-5-propan-2-yl-pyrazole

Systemtic Name: 3-methyl-1-(4-nitrophenyl)-5-propan-2-yl-pyrazole Openeye Name: 5-isopropyl-3-methyl-1-(4-nitrophenyl)pyrazole CAS Name: 3-methyl-1-(4-nitrophenyl)-5-propan-2-ylpyrazole IUPAC Name: 3-methyl-1-(4-nitrophenyl)-5-propan-2-ylpyrazole Traditional Name: 5-isopropyl-3-methyl-1-(4-nitrophenyl)pyrazole Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O2/c1-9(2)13-8-10(3)14-15(13)11-4-6-12(7-5-11)16(17)18/h4-9H,1-3H3