N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-2-(3-methoxy-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2-(3-methoxy-4-nitropyrazol-1-yl)acetamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide Formula: C16H15BrN6O4 MolecularWeight: 435.2321

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C16H15BrN6O4/c1-27-16-14(23(25)26)9-22(20-16)10-15(24)19-13-4-2-3-11(5-13)7-21-8-12(17)6-18-21/h2-6,8-9H,7,10H2,1H3,(H,19,24)