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

Systemtic Name: N-[[5-(2-iodanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine Openeye Name: N-[[5-(2-iodophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine CAS Name: N-[[5-(2-iodophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]ethanamine IUPAC Name: N-[[5-(2-iodophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]ethanamine Traditional Name: ethyl-[[5-(2-iodophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]amine Formula: C14H18IN3O MolecularWeight: 371.21669

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(N(N=C1C)C)OC2=CC=CC=C2I

Isomeric SMILES

CCNCC1=C(N(N=C1C)C)OC2=CC=CC=C2I

InChI

InChI=1S/C14H18IN3O/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