3-bromanyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline

Systemtic Name: 3-bromanyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline Openeye Name: 3-bromo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline CAS Name: 3-bromo-N-[(1,3,5-trimethyl-4-pyrazolyl)methyl]aniline IUPAC Name: 3-bromo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline Traditional Name: (3-bromophenyl)-[(1,3,5-trimethylpyrazol-4-yl)methyl]amine Formula: C13H16BrN3 MolecularWeight: 294.19024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CNC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)CNC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H16BrN3/c1-9-13(10(2)17(3)16-9)8-15-12-6-4-5-11(14)7-12/h4-7,15H,8H2,1-3H3