3-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propanenitrile

Systemtic Name: 3-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propanenitrile Openeye Name: 3-(2-hydroxy-4-oxo-chromen-3-yl)propanenitrile CAS Name: 3-(2-hydroxy-4-oxo-1-benzopyran-3-yl)propanenitrile IUPAC Name: 3-(2-hydroxy-4-oxochromen-3-yl)propanenitrile Traditional Name: 3-(2-hydroxy-4-keto-chromen-3-yl)propionitrile Formula: C12H9NO3 MolecularWeight: 215.20476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)CCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)CCC#N

InChI

InChI=1S/C12H9NO3/c13-7-3-5-9-11(14)8-4-1-2-6-10(8)16-12(9)15/h1-2,4,6,15H,3,5H2