8-iodanyl-7-phenylmethoxy-naphthalene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 8-iodanyl-7-phenylmethoxy-naphthalene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 7-benzyloxy-8-iodo-naphthalene-2-carboxamidine; 2,2,2-trifluoroacetic acid CAS Name: 8-iodo-7-phenylmethoxy-2-naphthalenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 8-iodo-7-phenylmethoxynaphthalene-2-carboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 7-benzoxy-8-iodo-2-naphthamidine; 2,2,2-trifluoroacetic acid Formula: C20H16F3IN2O3 MolecularWeight: 516.25232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C3=C(C=CC(=C3)C(=N)N)C=C2)I.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C3=C(C=CC(=C3)C(=N)N)C=C2)I.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C18H15IN2O.C2HF3O2/c19-17-15-10-14(18(20)21)7-6-13(15)8-9-16(17)22-11-12-4-2-1-3-5-12;3-2(4,5)1(6)7/h1-10H,11H2,(H3,20,21);(H,6,7)