3-bromanyl-3-(hydroxymethyl)-7-methoxy-2,2-dimethyl-chromen-4-one

Systemtic Name: 3-bromanyl-3-(hydroxymethyl)-7-methoxy-2,2-dimethyl-chromen-4-one Openeye Name: 3-bromo-3-(hydroxymethyl)-7-methoxy-2,2-dimethyl-chroman-4-one CAS Name: 3-bromo-3-(hydroxymethyl)-7-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3-bromo-3-(hydroxymethyl)-7-methoxy-2,2-dimethylchromen-4-one Traditional Name: 3-bromo-7-methoxy-2,2-dimethyl-3-methylol-chroman-4-one Formula: C13H15BrO4 MolecularWeight: 315.1598

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)C2=C(O1)C=C(C=C2)OC)(CO)Br)C

Isomeric SMILES

CC1(C(C(=O)C2=C(O1)C=C(C=C2)OC)(CO)Br)C

InChI

InChI=1S/C13H15BrO4/c1-12(2)13(14,7-15)11(16)9-5-4-8(17-3)6-10(9)18-12/h4-6,15H,7H2,1-3H3