3,3-bis(hydroxymethyl)-2H-thiochromen-4-one

Systemtic Name: 3,3-bis(hydroxymethyl)-2H-thiochromen-4-one Openeye Name: 3,3-bis(hydroxymethyl)thiochroman-4-one CAS Name: 3,3-bis(hydroxymethyl)-2H-1-benzothiopyran-4-one IUPAC Name: 3,3-bis(hydroxymethyl)-2H-thiochromen-4-one Traditional Name: 3,3-dimethylolthiochroman-4-one Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CC=C2S1)(CO)CO

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C2S1)(CO)CO

InChI

InChI=1S/C11H12O3S/c12-5-11(6-13)7-15-9-4-2-1-3-8(9)10(11)14/h1-4,12-13H,5-7H2