(4-heptoxyphenyl) 3-chloranyl-4-(2-chloranyl-3-methyl-butanoyl)oxy-benzoate

Systemtic Name: (4-heptoxyphenyl) 3-chloranyl-4-(2-chloranyl-3-methyl-butanoyl)oxy-benzoate Openeye Name: (4-heptoxyphenyl) 3-chloro-4-(2-chloro-3-methyl-butanoyl)oxy-benzoate CAS Name: 3-chloro-4-(2-chloro-3-methyl-1-oxobutoxy)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 3-chloro-4-(2-chloro-3-methylbutanoyl)oxybenzoate Traditional Name: 3-chloro-4-(2-chloro-3-methyl-butanoyl)oxy-benzoic acid (4-heptoxyphenyl) ester Formula: C25H30Cl2O5 MolecularWeight: 481.4087

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)C(C(C)C)Cl)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)C(C(C)C)Cl)Cl

InChI

InChI=1S/C25H30Cl2O5/c1-4-5-6-7-8-15-30-19-10-12-20(13-11-19)31-24(28)18-9-14-22(21(26)16-18)32-25(29)23(27)17(2)3/h9-14,16-17,23H,4-8,15H2,1-3H3