3-[4-(dimethylamino)-2-methyl-phenyl]-3-(2-propyl-1H-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(dimethylamino)-2-methyl-phenyl]-3-(2-propyl-1H-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[4-(dimethylamino)-2-methyl-phenyl]-3-(2-propyl-1H-indol-3-yl)isobenzofuran-1-one CAS Name: 3-[4-(dimethylamino)-2-methylphenyl]-3-(2-propyl-1H-indol-3-yl)-1-isobenzofuranone IUPAC Name: 3-[4-(dimethylamino)-2-methylphenyl]-3-(2-propyl-1H-indol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[4-(dimethylamino)-2-methyl-phenyl]-3-(2-propyl-1H-indol-3-yl)phthalide Formula: C28H28N2O2 MolecularWeight: 424.53412

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=CC=CC=C2N1)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(C)C)C

Isomeric SMILES

CCCC1=C(C2=CC=CC=C2N1)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(C)C)C

InChI

InChI=1S/C28H28N2O2/c1-5-10-25-26(21-12-7-9-14-24(21)29-25)28(22-16-15-19(30(3)4)17-18(22)2)23-13-8-6-11-20(23)27(31)32-28/h6-9,11-17,29H,5,10H2,1-4H3