4-bromanyl-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-nitro-aniline

Systemtic Name: 4-bromanyl-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-nitro-aniline Openeye Name: 4-bromo-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-nitro-aniline CAS Name: 4-bromo-N-[(1-tert-butyl-4-pyrazolyl)methyl]-2-nitroaniline IUPAC Name: 4-bromo-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-nitroaniline Traditional Name: (4-bromo-2-nitro-phenyl)-[(1-tert-butylpyrazol-4-yl)methyl]amine Formula: C14H17BrN4O2 MolecularWeight: 353.21438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=N1)CNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1C=C(C=N1)CNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H17BrN4O2/c1-14(2,3)18-9-10(8-17-18)7-16-12-5-4-11(15)6-13(12)19(20)21/h4-6,8-9,16H,7H2,1-3H3