dimethyl 2-iodanyl-5-(2-methylphenyl)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-iodanyl-5-(2-methylphenyl)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-iodo-5-(o-tolyl)benzene-1,4-dicarboxylate CAS Name: 2-iodo-5-(2-methylphenyl)benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-iodo-5-(2-methylphenyl)benzene-1,4-dicarboxylate Traditional Name: 2-iodo-5-(o-tolyl)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C17H15IO4 MolecularWeight: 410.20307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C(C=C2C(=O)OC)I)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C(C=C2C(=O)OC)I)C(=O)OC

InChI

InChI=1S/C17H15IO4/c1-10-6-4-5-7-11(10)12-8-14(17(20)22-3)15(18)9-13(12)16(19)21-2/h4-9H,1-3H3