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

Systemtic Name: 4-iodanyl-5-(2-methyl-4-phenylmethoxy-phenyl)-1H-pyrazol-3-amine Openeye Name: 5-(4-benzyloxy-2-methyl-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 4-iodo-5-(2-methyl-4-phenylmethoxyphenyl)-1H-pyrazol-3-amine IUPAC Name: 4-iodo-5-(2-methyl-4-phenylmethoxyphenyl)-1H-pyrazol-3-amine Traditional Name: [5-(4-benzoxy-2-methyl-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C17H16IN3O MolecularWeight: 405.23291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=CC=C2)C3=C(C(=NN3)N)I

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=CC=C2)C3=C(C(=NN3)N)I

InChI

InChI=1S/C17H16IN3O/c1-11-9-13(22-10-12-5-3-2-4-6-12)7-8-14(11)16-15(18)17(19)21-20-16/h2-9H,10H2,1H3,(H3,19,20,21)