5-(5-chloranyl-2-phenylmethoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-(5-chloranyl-2-phenylmethoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 5-(2-benzyloxy-5-chloro-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 5-(5-chloro-2-phenylmethoxyphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(5-chloro-2-phenylmethoxyphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [5-(2-benzoxy-5-chloro-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C16H13ClIN3O MolecularWeight: 425.65139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClIN3O/c17-11-6-7-13(22-9-10-4-2-1-3-5-10)12(8-11)15-14(18)16(19)21-20-15/h1-8H,9H2,(H3,19,20,21)