5-(5-tert-butyl-2-ethoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-(5-tert-butyl-2-ethoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 5-(5-tert-butyl-2-ethoxy-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 5-(5-tert-butyl-2-ethoxyphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(5-tert-butyl-2-ethoxyphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [5-(5-tert-butyl-2-ethoxy-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C15H20IN3O MolecularWeight: 385.24327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)(C)C)C2=C(C(=NN2)N)I

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)(C)C)C2=C(C(=NN2)N)I

InChI

InChI=1S/C15H20IN3O/c1-5-20-11-7-6-9(15(2,3)4)8-10(11)13-12(16)14(17)19-18-13/h6-8H,5H2,1-4H3,(H3,17,18,19)