2,2-dimethyl-5-oxidanyl-7-pentyl-3H-chromen-4-one

Systemtic Name: 2,2-dimethyl-5-oxidanyl-7-pentyl-3H-chromen-4-one Openeye Name: 5-hydroxy-2,2-dimethyl-7-pentyl-chroman-4-one CAS Name: 5-hydroxy-2,2-dimethyl-7-pentyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 5-hydroxy-2,2-dimethyl-7-pentyl-3H-chromen-4-one Traditional Name: 7-amyl-5-hydroxy-2,2-dimethyl-chroman-4-one Formula: C16H22O3 MolecularWeight: 262.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=O)CC(O2)(C)C)C(=C1)O

Isomeric SMILES

CCCCCC1=CC2=C(C(=O)CC(O2)(C)C)C(=C1)O

InChI

InChI=1S/C16H22O3/c1-4-5-6-7-11-8-12(17)15-13(18)10-16(2,3)19-14(15)9-11/h8-9,17H,4-7,10H2,1-3H3