methyl 4-iodanyl-3-nitroso-5-phenylmethoxy-benzoate

Systemtic Name: methyl 4-iodanyl-3-nitroso-5-phenylmethoxy-benzoate Openeye Name: methyl 3-benzyloxy-4-iodo-5-nitroso-benzoate CAS Name: 4-iodo-3-nitroso-5-phenylmethoxybenzoic acid methyl ester IUPAC Name: methyl 4-iodo-3-nitroso-5-phenylmethoxybenzoate Traditional Name: 3-benzoxy-4-iodo-5-nitroso-benzoic acid methyl ester Formula: C15H12INO4 MolecularWeight: 397.16455

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)I)N=O

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)I)N=O

InChI

InChI=1S/C15H12INO4/c1-20-15(18)11-7-12(17-19)14(16)13(8-11)21-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3