(2-iodanylphenyl)methyl 4-(1-methyl-1,2,3,4-tetrazol-5-yl)benzoate

Systemtic Name: (2-iodanylphenyl)methyl 4-(1-methyl-1,2,3,4-tetrazol-5-yl)benzoate Openeye Name: (2-iodophenyl)methyl 4-(1-methyltetrazol-5-yl)benzoate CAS Name: 4-(1-methyl-5-tetrazolyl)benzoic acid (2-iodophenyl)methyl ester IUPAC Name: (2-iodophenyl)methyl 4-(1-methyltetrazol-5-yl)benzoate Traditional Name: 4-(1-methyltetrazol-5-yl)benzoic acid (2-iodobenzyl) ester Formula: C16H13IN4O2 MolecularWeight: 420.20449

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3I

Isomeric SMILES

CN1C(=NN=N1)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3I

InChI

InChI=1S/C16H13IN4O2/c1-21-15(18-19-20-21)11-6-8-12(9-7-11)16(22)23-10-13-4-2-3-5-14(13)17/h2-9H,10H2,1H3