4-bromanyl-N-[(1-phenylpyrazol-4-yl)methyl]aniline

Systemtic Name: 4-bromanyl-N-[(1-phenylpyrazol-4-yl)methyl]aniline Openeye Name: 4-bromo-N-[(1-phenylpyrazol-4-yl)methyl]aniline CAS Name: 4-bromo-N-[(1-phenyl-4-pyrazolyl)methyl]aniline IUPAC Name: 4-bromo-N-[(1-phenylpyrazol-4-yl)methyl]aniline Traditional Name: (4-bromophenyl)-[(1-phenylpyrazol-4-yl)methyl]amine Formula: C16H14BrN3 MolecularWeight: 328.20646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN3/c17-14-6-8-15(9-7-14)18-10-13-11-19-20(12-13)16-4-2-1-3-5-16/h1-9,11-12,18H,10H2