[3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(3,5-dimethylpyrazol-1-yl)methanone

Systemtic Name: [3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(3,5-dimethylpyrazol-1-yl)methanone Openeye Name: [3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]phenyl]-(3,5-dimethylpyrazol-1-yl)methanone CAS Name: [3-[(4-bromo-3-nitro-1-pyrazolyl)methyl]phenyl]-(3,5-dimethyl-1-pyrazolyl)methanone IUPAC Name: [3-[(4-bromo-3-nitropyrazol-1-yl)methyl]phenyl]-(3,5-dimethylpyrazol-1-yl)methanone Traditional Name: [3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]phenyl]-(3,5-dimethylpyrazol-1-yl)methanone Formula: C16H14BrN5O3 MolecularWeight: 404.21806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br)C

InChI

InChI=1S/C16H14BrN5O3/c1-10-6-11(2)21(18-10)16(23)13-5-3-4-12(7-13)8-20-9-14(17)15(19-20)22(24)25/h3-7,9H,8H2,1-2H3