methyl 1-[(2-iodanylphenyl)methyl]cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: methyl 1-[(2-iodanylphenyl)methyl]cyclohexa-2,5-diene-1-carboxylate Openeye Name: methyl 1-[(2-iodophenyl)methyl]cyclohexa-2,5-diene-1-carboxylate CAS Name: 1-[(2-iodophenyl)methyl]-1-cyclohexa-2,5-dienecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-iodophenyl)methyl]cyclohexa-2,5-diene-1-carboxylate Traditional Name: 1-(2-iodobenzyl)cyclohexa-2,5-diene-1-carboxylic acid methyl ester Formula: C15H15IO2 MolecularWeight: 354.18287

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C=CCC=C1)CC2=CC=CC=C2I

Isomeric SMILES

COC(=O)C1(C=CCC=C1)CC2=CC=CC=C2I

InChI

InChI=1S/C15H15IO2/c1-18-14(17)15(9-5-2-6-10-15)11-12-7-3-4-8-13(12)16/h3-10H,2,11H2,1H3