1-[2,2-dimethyl-7-(2-methylbut-3-yn-2-yloxy)-5-oxidanyl-chromen-6-yl]ethanone

Systemtic Name: 1-[2,2-dimethyl-7-(2-methylbut-3-yn-2-yloxy)-5-oxidanyl-chromen-6-yl]ethanone Openeye Name: 1-[7-(1,1-dimethylprop-2-ynoxy)-5-hydroxy-2,2-dimethyl-chromen-6-yl]ethanone CAS Name: 1-[5-hydroxy-2,2-dimethyl-7-(2-methylbut-3-yn-2-yloxy)-1-benzopyran-6-yl]ethanone IUPAC Name: 1-[5-hydroxy-2,2-dimethyl-7-(2-methylbut-3-yn-2-yloxy)chromen-6-yl]ethanone Traditional Name: 1-[7-(1,1-dimethylprop-2-ynoxy)-5-hydroxy-2,2-dimethyl-chromen-6-yl]ethanone Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C2C(=C1O)C=CC(O2)(C)C)OC(C)(C)C#C

Isomeric SMILES

CC(=O)C1=C(C=C2C(=C1O)C=CC(O2)(C)C)OC(C)(C)C#C

InChI

InChI=1S/C18H20O4/c1-7-17(3,4)22-14-10-13-12(8-9-18(5,6)21-13)16(20)15(14)11(2)19/h1,8-10,20H,2-6H3