3-(bromomethyl)-1-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-pyrazole

Systemtic Name: 3-(bromomethyl)-1-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-pyrazole Openeye Name: 3-(bromomethyl)-1-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-pyrazole CAS Name: 3-(bromomethyl)-1-methyl-4-[(4-nitrophenyl)methyl]-5-propylpyrazole IUPAC Name: 3-(bromomethyl)-1-methyl-4-[(4-nitrophenyl)methyl]-5-propylpyrazole Traditional Name: 3-(bromomethyl)-1-methyl-4-(4-nitrobenzyl)-5-propyl-pyrazole Formula: C15H18BrN3O2 MolecularWeight: 352.22632

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C)CBr)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C(=NN1C)CBr)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18BrN3O2/c1-3-4-15-13(14(10-16)17-18(15)2)9-11-5-7-12(8-6-11)19(20)21/h5-8H,3-4,9-10H2,1-2H3