3-(3,4-dimethoxyphenyl)-6-(dimethylamino)-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-6-(dimethylamino)-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-(3,4-dimethoxyphenyl)-6-(dimethylamino)-3-(2-methyl-1-octyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-(3,4-dimethoxyphenyl)-6-(dimethylamino)-3-(2-methyl-1-octyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-(3,4-dimethoxyphenyl)-6-(dimethylamino)-3-(2-methyl-1-octylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-(3,4-dimethoxyphenyl)-6-(dimethylamino)-3-(2-methyl-1-octyl-indol-3-yl)phthalide Formula: C35H42N2O4 MolecularWeight: 554.71898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H42N2O4/c1-7-8-9-10-11-14-21-37-24(2)33(27-15-12-13-16-30(27)37)35(25-17-20-31(39-5)32(22-25)40-6)29-19-18-26(36(3)4)23-28(29)34(38)41-35/h12-13,15-20,22-23H,7-11,14,21H2,1-6H3