5-[(2-bromophenyl)methyl]-3-(4-nitrophenyl)-1H-pyrazole

Systemtic Name: 5-[(2-bromophenyl)methyl]-3-(4-nitrophenyl)-1H-pyrazole Openeye Name: 5-[(2-bromophenyl)methyl]-3-(4-nitrophenyl)-1H-pyrazole CAS Name: 5-[(2-bromophenyl)methyl]-3-(4-nitrophenyl)-1H-pyrazole IUPAC Name: 5-[(2-bromophenyl)methyl]-3-(4-nitrophenyl)-1H-pyrazole Traditional Name: 5-(2-bromobenzyl)-3-(4-nitrophenyl)-1H-pyrazole Formula: C16H12BrN3O2 MolecularWeight: 358.18938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC(=NN2)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC(=NN2)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H12BrN3O2/c17-15-4-2-1-3-12(15)9-13-10-16(19-18-13)11-5-7-14(8-6-11)20(21)22/h1-8,10H,9H2,(H,18,19)