2-[3-chloranyl-6-oxidanyl-4-oxidanylidene-5-(2,4,6-trimethylphenyl)pyran-2-yl]propan-2-yl ethanoate

Systemtic Name: 2-[3-chloranyl-6-oxidanyl-4-oxidanylidene-5-(2,4,6-trimethylphenyl)pyran-2-yl]propan-2-yl ethanoate Openeye Name: [1-[3-chloro-6-hydroxy-4-oxo-5-(2,4,6-trimethylphenyl)pyran-2-yl]-1-methyl-ethyl] acetate CAS Name: acetic acid 2-[3-chloro-6-hydroxy-4-oxo-5-(2,4,6-trimethylphenyl)-2-pyranyl]propan-2-yl ester IUPAC Name: 2-[3-chloro-6-hydroxy-4-oxo-5-(2,4,6-trimethylphenyl)pyran-2-yl]propan-2-yl acetate Traditional Name: acetic acid [1-(3-chloro-6-hydroxy-4-keto-5-mesityl-pyran-2-yl)-1-methyl-ethyl] ester Formula: C19H21ClO5 MolecularWeight: 364.82004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClO5/c1-9-7-10(2)13(11(3)8-9)14-16(22)15(20)17(24-18(14)23)19(5,6)25-12(4)21/h7-8,23H,1-6H3