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

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-2-(3-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2-(3-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-2-(3-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2-(3-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2-(3-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C17H17BrN6O3 MolecularWeight: 433.25928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])C(C)C(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])C(C)C(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C17H17BrN6O3/c1-11-16(24(26)27)10-23(21-11)12(2)17(25)20-15-5-3-4-13(6-15)8-22-9-14(18)7-19-22/h3-7,9-10,12H,8H2,1-2H3,(H,20,25)