(4-iodophenyl) 3,5-bis(chloranyl)-4-heptoxy-benzoate

Systemtic Name: (4-iodophenyl) 3,5-bis(chloranyl)-4-heptoxy-benzoate Openeye Name: (4-iodophenyl) 3,5-dichloro-4-heptoxy-benzoate CAS Name: 3,5-dichloro-4-heptoxybenzoic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 3,5-dichloro-4-heptoxybenzoate Traditional Name: 3,5-dichloro-4-heptoxy-benzoic acid (4-iodophenyl) ester Formula: C20H21Cl2IO3 MolecularWeight: 507.18941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1Cl)C(=O)OC2=CC=C(C=C2)I)Cl

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1Cl)C(=O)OC2=CC=C(C=C2)I)Cl

InChI

InChI=1S/C20H21Cl2IO3/c1-2-3-4-5-6-11-25-19-17(21)12-14(13-18(19)22)20(24)26-16-9-7-15(23)8-10-16/h7-10,12-13H,2-6,11H2,1H3