(2-iodanylphenyl)methyl 3,5-dinitrobenzoate

Systemtic Name: (2-iodanylphenyl)methyl 3,5-dinitrobenzoate Openeye Name: (2-iodophenyl)methyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-iodophenyl)methyl ester IUPAC Name: (2-iodophenyl)methyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-iodobenzyl) ester Formula: C14H9IN2O6 MolecularWeight: 428.13553

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])I

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])I

InChI

InChI=1S/C14H9IN2O6/c15-13-4-2-1-3-9(13)8-23-14(18)10-5-11(16(19)20)7-12(6-10)17(21)22/h1-7H,8H2