4-iodanyl-5-(2-phenylmethoxyphenyl)-1H-pyrazol-3-amine

Systemtic Name: 4-iodanyl-5-(2-phenylmethoxyphenyl)-1H-pyrazol-3-amine Openeye Name: 5-(2-benzyloxyphenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 4-iodo-5-(2-phenylmethoxyphenyl)-1H-pyrazol-3-amine IUPAC Name: 4-iodo-5-(2-phenylmethoxyphenyl)-1H-pyrazol-3-amine Traditional Name: [5-(2-benzoxyphenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C16H14IN3O MolecularWeight: 391.20633

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C3=C(C(=NN3)N)I

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C3=C(C(=NN3)N)I

InChI

InChI=1S/C16H14IN3O/c17-14-15(19-20-16(14)18)12-8-4-5-9-13(12)21-10-11-6-2-1-3-7-11/h1-9H,10H2,(H3,18,19,20)