ethyl 6-(4-chlorophenyl)-3,5,5-trimethyl-2,4-bis(oxidanylidene)oxane-3-carboxylate

Systemtic Name: ethyl 6-(4-chlorophenyl)-3,5,5-trimethyl-2,4-bis(oxidanylidene)oxane-3-carboxylate Openeye Name: ethyl 6-(4-chlorophenyl)-3,5,5-trimethyl-2,4-dioxo-tetrahydropyran-3-carboxylate CAS Name: 6-(4-chlorophenyl)-3,5,5-trimethyl-2,4-dioxo-3-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-chlorophenyl)-3,5,5-trimethyl-2,4-dioxooxane-3-carboxylate Traditional Name: 6-(4-chlorophenyl)-2,4-diketo-3,5,5-trimethyl-tetrahydropyran-3-carboxylic acid ethyl ester Formula: C17H19ClO5 MolecularWeight: 338.78276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClO5/c1-5-22-14(20)17(4)13(19)16(2,3)12(23-15(17)21)10-6-8-11(18)9-7-10/h6-9,12H,5H2,1-4H3