methyl 2-[(4-chlorophenyl)methyl]-4-iodanyl-5,5-dimethyl-cyclopentene-1-carboxylate

Systemtic Name: methyl 2-[(4-chlorophenyl)methyl]-4-iodanyl-5,5-dimethyl-cyclopentene-1-carboxylate Openeye Name: methyl 2-[(4-chlorophenyl)methyl]-4-iodo-5,5-dimethyl-cyclopentene-1-carboxylate CAS Name: 2-[(4-chlorophenyl)methyl]-4-iodo-5,5-dimethyl-1-cyclopentenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chlorophenyl)methyl]-4-iodo-5,5-dimethylcyclopentene-1-carboxylate Traditional Name: 2-(4-chlorobenzyl)-4-iodo-5,5-dimethyl-cyclopentene-1-carboxylic acid methyl ester Formula: C16H18ClIO2 MolecularWeight: 404.67039

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC(=C1C(=O)OC)CC2=CC=C(C=C2)Cl)I)C

Isomeric SMILES

CC1(C(CC(=C1C(=O)OC)CC2=CC=C(C=C2)Cl)I)C

InChI

InChI=1S/C16H18ClIO2/c1-16(2)13(18)9-11(14(16)15(19)20-3)8-10-4-6-12(17)7-5-10/h4-7,13H,8-9H2,1-3H3