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

Systemtic Name: N-[[5-(2-iodanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine Openeye Name: N-[[5-(2-iodophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine CAS Name: N-[[5-(2-iodophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]cyclopropanamine IUPAC Name: N-[[5-(2-iodophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]cyclopropanamine Traditional Name: cyclopropyl-[[5-(2-iodophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]amine Formula: C15H18IN3O MolecularWeight: 383.22739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CNC2CC2)OC3=CC=CC=C3I)C

Isomeric SMILES

CC1=NN(C(=C1CNC2CC2)OC3=CC=CC=C3I)C

InChI

InChI=1S/C15H18IN3O/c1-10-12(9-17-11-7-8-11)15(19(2)18-10)20-14-6-4-3-5-13(14)16/h3-6,11,17H,7-9H2,1-2H3