[3-methyl-1-(5-methyl-2-oxidanyl-4-oxidanylidene-chromen-3-yl)-3-oxidanyl-butan-2-yl] ethanoate

Systemtic Name: [3-methyl-1-(5-methyl-2-oxidanyl-4-oxidanylidene-chromen-3-yl)-3-oxidanyl-butan-2-yl] ethanoate Openeye Name: [2-hydroxy-1-[(2-hydroxy-5-methyl-4-oxo-chromen-3-yl)methyl]-2-methyl-propyl] acetate CAS Name: acetic acid [3-hydroxy-1-(2-hydroxy-5-methyl-4-oxo-1-benzopyran-3-yl)-3-methylbutan-2-yl] ester IUPAC Name: [3-hydroxy-1-(2-hydroxy-5-methyl-4-oxochromen-3-yl)-3-methylbutan-2-yl] acetate Traditional Name: acetic acid [2-hydroxy-1-[(2-hydroxy-4-keto-5-methyl-chromen-3-yl)methyl]-2-methyl-propyl] ester Formula: C17H20O6 MolecularWeight: 320.3371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=C(C2=O)CC(C(C)(C)O)OC(=O)C)O

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=C(C2=O)CC(C(C)(C)O)OC(=O)C)O

InChI

InChI=1S/C17H20O6/c1-9-6-5-7-12-14(9)15(19)11(16(20)23-12)8-13(17(3,4)21)22-10(2)18/h5-7,13,20-21H,8H2,1-4H3