bis[2,4-bis(chloranyl)-3-octyl-6-propan-2-yloxycarbonyl-phenyl] ethanedioate

Systemtic Name: bis[2,4-bis(chloranyl)-3-octyl-6-propan-2-yloxycarbonyl-phenyl] ethanedioate Openeye Name: bis(2,4-dichloro-6-isopropoxycarbonyl-3-octyl-phenyl) oxalate CAS Name: oxalic acid bis[2,4-dichloro-3-octyl-6-[oxo(propan-2-yloxy)methyl]phenyl] ester IUPAC Name: bis(2,4-dichloro-3-octyl-6-propan-2-yloxycarbonylphenyl) oxalate Traditional Name: oxalic acid bis(2,4-dichloro-6-isopropoxycarbonyl-3-octyl-phenyl) ester Formula: C38H50Cl4O8 MolecularWeight: 776.6108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=C(C(=C1Cl)OC(=O)C(=O)OC2=C(C(=C(C=C2C(=O)OC(C)C)Cl)CCCCCCCC)Cl)C(=O)OC(C)C)Cl

Isomeric SMILES

CCCCCCCCC1=C(C=C(C(=C1Cl)OC(=O)C(=O)OC2=C(C(=C(C=C2C(=O)OC(C)C)Cl)CCCCCCCC)Cl)C(=O)OC(C)C)Cl

InChI

InChI=1S/C38H50Cl4O8/c1-7-9-11-13-15-17-19-25-29(39)21-27(35(43)47-23(3)4)33(31(25)41)49-37(45)38(46)50-34-28(36(44)48-24(5)6)22-30(40)26(32(34)42)20-18-16-14-12-10-8-2/h21-24H,7-20H2,1-6H3