dimethyl 2-[9-(2,4-dichlorophenyl)-1-oxidanyl-nonyl]-2-oxidanyl-butanedioate

Systemtic Name: dimethyl 2-[9-(2,4-dichlorophenyl)-1-oxidanyl-nonyl]-2-oxidanyl-butanedioate Openeye Name: dimethyl 2-[9-(2,4-dichlorophenyl)-1-hydroxy-nonyl]-2-hydroxy-butanedioate CAS Name: 2-[9-(2,4-dichlorophenyl)-1-hydroxynonyl]-2-hydroxybutanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[9-(2,4-dichlorophenyl)-1-hydroxynonyl]-2-hydroxybutanedioate Traditional Name: 2-[9-(2,4-dichlorophenyl)-1-hydroxy-nonyl]-2-hydroxy-succinic acid dimethyl ester Formula: C21H30Cl2O6 MolecularWeight: 449.3653

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(CCCCCCCCC1=C(C=C(C=C1)Cl)Cl)O)(C(=O)OC)O

Isomeric SMILES

COC(=O)CC(C(CCCCCCCCC1=C(C=C(C=C1)Cl)Cl)O)(C(=O)OC)O

InChI

InChI=1S/C21H30Cl2O6/c1-28-19(25)14-21(27,20(26)29-2)18(24)10-8-6-4-3-5-7-9-15-11-12-16(22)13-17(15)23/h11-13,18,24,27H,3-10,14H2,1-2H3