5-(4-ethoxy-2,5-dimethyl-phenyl)-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-(4-ethoxy-2,5-dimethyl-phenyl)-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 5-(4-ethoxy-2,5-dimethyl-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 5-(4-ethoxy-2,5-dimethylphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(4-ethoxy-2,5-dimethylphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [5-(4-ethoxy-2,5-dimethyl-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C13H16IN3O MolecularWeight: 357.19011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16IN3O/c1-4-18-10-6-7(2)9(5-8(10)3)12-11(14)13(15)17-16-12/h5-6H,4H2,1-3H3,(H3,15,16,17)