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

Systemtic Name: N-[[5-(3-bromanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]propan-1-amine Openeye Name: N-[[5-(3-bromophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]propan-1-amine CAS Name: N-[[5-(3-bromophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]-1-propanamine IUPAC Name: N-[[5-(3-bromophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]propan-1-amine Traditional Name: [5-(3-bromophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-propyl-amine Formula: C15H20BrN3O MolecularWeight: 338.2428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(N(N=C1C)C)OC2=CC(=CC=C2)Br

Isomeric SMILES

CCCNCC1=C(N(N=C1C)C)OC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H20BrN3O/c1-4-8-17-10-14-11(2)18-19(3)15(14)20-13-7-5-6-12(16)9-13/h5-7,9,17H,4,8,10H2,1-3H3