3-(2-methyl-4-octyl-1H-indol-3-yl)-3H-2-benzofuran-1-one

Systemtic Name: 3-(2-methyl-4-octyl-1H-indol-3-yl)-3H-2-benzofuran-1-one Openeye Name: 3-(2-methyl-4-octyl-1H-indol-3-yl)-3H-isobenzofuran-1-one CAS Name: 3-(2-methyl-4-octyl-1H-indol-3-yl)-3H-isobenzofuran-1-one IUPAC Name: 3-(2-methyl-4-octyl-1H-indol-3-yl)-3H-2-benzofuran-1-one Traditional Name: 3-(2-methyl-4-octyl-1H-indol-3-yl)phthalide Formula: C25H29NO2 MolecularWeight: 375.50326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C2C(=CC=C1)NC(=C2C3C4=CC=CC=C4C(=O)O3)C

Isomeric SMILES

CCCCCCCCC1=C2C(=CC=C1)NC(=C2C3C4=CC=CC=C4C(=O)O3)C

InChI

InChI=1S/C25H29NO2/c1-3-4-5-6-7-8-12-18-13-11-16-21-23(18)22(17(2)26-21)24-19-14-9-10-15-20(19)25(27)28-24/h9-11,13-16,24,26H,3-8,12H2,1-2H3