dimethyl 2-(5-chloranyl-2-oxidanyl-phenyl)butanedioate

Systemtic Name: dimethyl 2-(5-chloranyl-2-oxidanyl-phenyl)butanedioate Openeye Name: dimethyl 2-(5-chloro-2-hydroxy-phenyl)butanedioate CAS Name: 2-(5-chloro-2-hydroxyphenyl)butanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(5-chloro-2-hydroxyphenyl)butanedioate Traditional Name: 2-(5-chloro-2-hydroxy-phenyl)succinic acid dimethyl ester Formula: C12H13ClO5 MolecularWeight: 272.68162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO5/c1-17-11(15)6-9(12(16)18-2)8-5-7(13)3-4-10(8)14/h3-5,9,14H,6H2,1-2H3