(2-oxidanylidene-3-phenyl-chromen-4-yl) 4-methylpentanoate

Systemtic Name: (2-oxidanylidene-3-phenyl-chromen-4-yl) 4-methylpentanoate Openeye Name: (2-oxo-3-phenyl-chromen-4-yl) 4-methylpentanoate CAS Name: 4-methylpentanoic acid (2-oxo-3-phenyl-1-benzopyran-4-yl) ester IUPAC Name: (2-oxo-3-phenylchromen-4-yl) 4-methylpentanoate Traditional Name: 4-methylvaleric acid (2-keto-3-phenyl-chromen-4-yl) ester Formula: C21H20O4 MolecularWeight: 336.3811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)OC1=C(C(=O)OC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCC(=O)OC1=C(C(=O)OC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C21H20O4/c1-14(2)12-13-18(22)25-20-16-10-6-7-11-17(16)24-21(23)19(20)15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3