ethyl (3S,6R)-6-(2,4-dichlorophenyl)-3,5,5-trimethyl-2,4-bis(oxidanylidene)oxane-3-carboxylate

Systemtic Name: ethyl (3S,6R)-6-(2,4-dichlorophenyl)-3,5,5-trimethyl-2,4-bis(oxidanylidene)oxane-3-carboxylate Openeye Name: ethyl (3S,6R)-6-(2,4-dichlorophenyl)-3,5,5-trimethyl-2,4-dioxo-tetrahydropyran-3-carboxylate CAS Name: (3S,6R)-6-(2,4-dichlorophenyl)-3,5,5-trimethyl-2,4-dioxo-3-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl (3S,6R)-6-(2,4-dichlorophenyl)-3,5,5-trimethyl-2,4-dioxooxane-3-carboxylate Traditional Name: (3S,6R)-6-(2,4-dichlorophenyl)-2,4-diketo-3,5,5-trimethyl-tetrahydropyran-3-carboxylic acid ethyl ester Formula: C17H18Cl2O5 MolecularWeight: 373.22782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=O)C(C(OC1=O)C2=C(C=C(C=C2)Cl)Cl)(C)C)C

Isomeric SMILES

CCOC(=O)[C@@]1(C(=O)C([C@@H](OC1=O)C2=C(C=C(C=C2)Cl)Cl)(C)C)C

InChI

InChI=1S/C17H18Cl2O5/c1-5-23-14(21)17(4)13(20)16(2,3)12(24-15(17)22)10-7-6-9(18)8-11(10)19/h6-8,12H,5H2,1-4H3/t12-,17-/m0/s1