N-[[5-(2-bromanyl-4-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]propan-1-amine

Systemtic Name: N-[[5-(2-bromanyl-4-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]propan-1-amine Openeye Name: N-[[5-(2-bromo-4-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]propan-1-amine CAS Name: N-[[5-(2-bromo-4-methylphenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]-1-propanamine IUPAC Name: N-[[5-(2-bromo-4-methylphenoxy)-1,3-dimethylpyrazol-4-yl]methyl]propan-1-amine Traditional Name: [5-(2-bromo-4-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-propyl-amine Formula: C16H22BrN3O MolecularWeight: 352.26938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrN3O/c1-5-8-18-10-13-12(3)19-20(4)16(13)21-15-7-6-11(2)9-14(15)17/h6-7,9,18H,5,8,10H2,1-4H3