methyl 6-(4-bromophenyl)-3,5,5-trimethyl-2,4-bis(oxidanylidene)oxane-3-carboxylate

Systemtic Name: methyl 6-(4-bromophenyl)-3,5,5-trimethyl-2,4-bis(oxidanylidene)oxane-3-carboxylate Openeye Name: methyl 6-(4-bromophenyl)-3,5,5-trimethyl-2,4-dioxo-tetrahydropyran-3-carboxylate CAS Name: 6-(4-bromophenyl)-3,5,5-trimethyl-2,4-dioxo-3-oxanecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-bromophenyl)-3,5,5-trimethyl-2,4-dioxooxane-3-carboxylate Traditional Name: 6-(4-bromophenyl)-2,4-diketo-3,5,5-trimethyl-tetrahydropyran-3-carboxylic acid methyl ester Formula: C16H17BrO5 MolecularWeight: 369.20718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC(=O)C(C1=O)(C)C(=O)OC)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1(C(OC(=O)C(C1=O)(C)C(=O)OC)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C16H17BrO5/c1-15(2)11(9-5-7-10(17)8-6-9)22-14(20)16(3,12(15)18)13(19)21-4/h5-8,11H,1-4H3