(3R)-3-[(2S)-2-ethylhexoxy]-3-phenyl-2-benzofuran-1-one

Systemtic Name: (3R)-3-[(2S)-2-ethylhexoxy]-3-phenyl-2-benzofuran-1-one Openeye Name: (3R)-3-[(2S)-2-ethylhexoxy]-3-phenyl-isobenzofuran-1-one CAS Name: (3R)-3-[(2S)-2-ethylhexoxy]-3-phenyl-1-isobenzofuranone IUPAC Name: (3R)-3-[(2S)-2-ethylhexoxy]-3-phenyl-2-benzofuran-1-one Traditional Name: (3R)-3-[(2S)-2-ethylhexoxy]-3-phenyl-phthalide Formula: C22H26O3 MolecularWeight: 338.44004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1(C2=CC=CC=C2C(=O)O1)C3=CC=CC=C3

Isomeric SMILES

CCCC[C@H](CC)CO[C@]1(C2=CC=CC=C2C(=O)O1)C3=CC=CC=C3

InChI

InChI=1S/C22H26O3/c1-3-5-11-17(4-2)16-24-22(18-12-7-6-8-13-18)20-15-10-9-14-19(20)21(23)25-22/h6-10,12-15,17H,3-5,11,16H2,1-2H3/t17-,22+/m0/s1