(phenylmethyl) 2,2-bis[3,5-bis(chloranyl)-4-oxidanyl-phenyl]ethanoate

Systemtic Name: (phenylmethyl) 2,2-bis[3,5-bis(chloranyl)-4-oxidanyl-phenyl]ethanoate Openeye Name: benzyl 2,2-bis(3,5-dichloro-4-hydroxy-phenyl)acetate CAS Name: 2,2-bis(3,5-dichloro-4-hydroxyphenyl)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2,2-bis(3,5-dichloro-4-hydroxyphenyl)acetate Traditional Name: 2,2-bis(3,5-dichloro-4-hydroxy-phenyl)acetic acid benzyl ester Formula: C21H14Cl4O4 MolecularWeight: 472.14546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(C2=CC(=C(C(=C2)Cl)O)Cl)C3=CC(=C(C(=C3)Cl)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(C2=CC(=C(C(=C2)Cl)O)Cl)C3=CC(=C(C(=C3)Cl)O)Cl

InChI

InChI=1S/C21H14Cl4O4/c22-14-6-12(7-15(23)19(14)26)18(13-8-16(24)20(27)17(25)9-13)21(28)29-10-11-4-2-1-3-5-11/h1-9,18,26-27H,10H2