3-[6-(dimethylamino)-3-methyl-1-benzofuran-2-yl]-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[6-(dimethylamino)-3-methyl-1-benzofuran-2-yl]-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[6-(dimethylamino)-3-methyl-benzofuran-2-yl]-3-(2-methyl-1-octyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-[6-(dimethylamino)-3-methyl-2-benzofuranyl]-3-(2-methyl-1-octyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-[6-(dimethylamino)-3-methyl-1-benzofuran-2-yl]-3-(2-methyl-1-octylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[6-(dimethylamino)-3-methyl-benzofuran-2-yl]-3-(2-methyl-1-octyl-indol-3-yl)phthalide Formula: C36H40N2O3 MolecularWeight: 548.7144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C6=C(O5)C=C(C=C6)N(C)C)C)C

Isomeric SMILES

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C6=C(O5)C=C(C=C6)N(C)C)C)C

InChI

InChI=1S/C36H40N2O3/c1-6-7-8-9-10-15-22-38-25(3)33(29-17-12-14-19-31(29)38)36(30-18-13-11-16-28(30)35(39)41-36)34-24(2)27-21-20-26(37(4)5)23-32(27)40-34/h11-14,16-21,23H,6-10,15,22H2,1-5H3