3-(hydroxymethyl)-5-(2-methylpropoxy)chromen-4-one

Systemtic Name: 3-(hydroxymethyl)-5-(2-methylpropoxy)chromen-4-one Openeye Name: 3-(hydroxymethyl)-5-isobutoxy-chromen-4-one CAS Name: 3-(hydroxymethyl)-5-(2-methylpropoxy)-1-benzopyran-4-one IUPAC Name: 3-(hydroxymethyl)-5-(2-methylpropoxy)chromen-4-one Traditional Name: 5-isobutoxy-3-methylol-chromone Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC2=C1C(=O)C(=CO2)CO

Isomeric SMILES

CC(C)COC1=CC=CC2=C1C(=O)C(=CO2)CO

InChI

InChI=1S/C14H16O4/c1-9(2)7-17-11-4-3-5-12-13(11)14(16)10(6-15)8-18-12/h3-5,8-9,15H,6-7H2,1-2H3