6-methoxy-8-oxidanyl-3-(3-oxidanylidenebutan-2-yl)isochromen-1-one

Systemtic Name: 6-methoxy-8-oxidanyl-3-(3-oxidanylidenebutan-2-yl)isochromen-1-one Openeye Name: 8-hydroxy-6-methoxy-3-(1-methyl-2-oxo-propyl)isochromen-1-one CAS Name: 8-hydroxy-6-methoxy-3-(3-oxobutan-2-yl)-2-benzopyran-1-one IUPAC Name: 8-hydroxy-6-methoxy-3-(3-oxobutan-2-yl)isochromen-1-one Traditional Name: 8-hydroxy-3-(2-keto-1-methyl-propyl)-6-methoxy-isocoumarin Formula: C14H14O5 MolecularWeight: 262.25796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC(=CC(=C2C(=O)O1)O)OC)C(=O)C

Isomeric SMILES

CC(C1=CC2=CC(=CC(=C2C(=O)O1)O)OC)C(=O)C

InChI

InChI=1S/C14H14O5/c1-7(8(2)15)12-5-9-4-10(18-3)6-11(16)13(9)14(17)19-12/h4-7,16H,1-3H3