4-bromanyl-5-[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]-1-methyl-pyrazole

Systemtic Name: 4-bromanyl-5-[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]-1-methyl-pyrazole Openeye Name: 4-bromo-5-[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]-1-methyl-pyrazole CAS Name: 4-bromo-5-[2-[(4-chlorophenyl)methoxy]-5-nitrophenyl]-1-methylpyrazole IUPAC Name: 4-bromo-5-[2-[(4-chlorophenyl)methoxy]-5-nitrophenyl]-1-methylpyrazole Traditional Name: 4-bromo-5-[2-(4-chlorobenzyl)oxy-5-nitro-phenyl]-1-methyl-pyrazole Formula: C17H13BrClN3O3 MolecularWeight: 422.66042

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13BrClN3O3/c1-21-17(15(18)9-20-21)14-8-13(22(23)24)6-7-16(14)25-10-11-2-4-12(19)5-3-11/h2-9H,10H2,1H3