5-[2,5-bis(chloranyl)-4-phenylmethoxy-phenyl]-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-[2,5-bis(chloranyl)-4-phenylmethoxy-phenyl]-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 5-(4-benzyloxy-2,5-dichloro-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 5-(2,5-dichloro-4-phenylmethoxyphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(2,5-dichloro-4-phenylmethoxyphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [5-(4-benzoxy-2,5-dichloro-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C16H12Cl2IN3O MolecularWeight: 460.09645

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C(=C2)Cl)C3=C(C(=NN3)N)I)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C(=C2)Cl)C3=C(C(=NN3)N)I)Cl

InChI

InChI=1S/C16H12Cl2IN3O/c17-11-7-13(23-8-9-4-2-1-3-5-9)12(18)6-10(11)15-14(19)16(20)22-21-15/h1-7H,8H2,(H3,20,21,22)