3-[4-(diethylamino)-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(diethylamino)-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[4-(diethylamino)-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(2-methyl-1-octyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(2-methyl-1-octyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(2-methyl-1-octylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[4-(diethylamino)-2-p-anisyloxy-phenyl]-3-(2-methyl-1-octyl-indol-3-yl)phthalide Formula: C43H50N2O4 MolecularWeight: 658.8681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC6=CC=C(C=C6)OC)C

Isomeric SMILES

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC6=CC=C(C=C6)OC)C

InChI

InChI=1S/C43H50N2O4/c1-6-9-10-11-12-17-28-45-31(4)41(36-19-14-16-21-39(36)45)43(37-20-15-13-18-35(37)42(46)49-43)38-27-24-33(44(7-2)8-3)29-40(38)48-30-32-22-25-34(47-5)26-23-32/h13-16,18-27,29H,6-12,17,28,30H2,1-5H3