3-ethanoyl-5-(hydroxymethyl)-7-oxidanyl-chromen-2-one

Systemtic Name: 3-ethanoyl-5-(hydroxymethyl)-7-oxidanyl-chromen-2-one Openeye Name: 3-acetyl-7-hydroxy-5-(hydroxymethyl)chromen-2-one CAS Name: 3-acetyl-7-hydroxy-5-(hydroxymethyl)-1-benzopyran-2-one IUPAC Name: 3-acetyl-7-hydroxy-5-(hydroxymethyl)chromen-2-one Traditional Name: 3-acetyl-7-hydroxy-5-methylol-coumarin Formula: C12H10O5 MolecularWeight: 234.2048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C(C=C2CO)O)OC1=O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C(C=C2CO)O)OC1=O

InChI

InChI=1S/C12H10O5/c1-6(14)9-4-10-7(5-13)2-8(15)3-11(10)17-12(9)16/h2-4,13,15H,5H2,1H3