N-[[5-(2-bromanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine

Systemtic Name: N-[[5-(2-bromanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine Openeye Name: N-[[5-(2-bromophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine CAS Name: N-[[5-(2-bromophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]ethanamine IUPAC Name: N-[[5-(2-bromophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]ethanamine Traditional Name: [5-(2-bromophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-ethyl-amine Formula: C14H18BrN3O MolecularWeight: 324.21622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(N(N=C1C)C)OC2=CC=CC=C2Br

Isomeric SMILES

CCNCC1=C(N(N=C1C)C)OC2=CC=CC=C2Br

InChI

InChI=1S/C14H18BrN3O/c1-4-16-9-11-10(2)17-18(3)14(11)19-13-8-6-5-7-12(13)15/h5-8,16H,4,9H2,1-3H3