3-[4-(diethylamino)-2-phenylmethoxy-phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(diethylamino)-2-phenylmethoxy-phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[2-benzyloxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-phenylmethoxyphenyl]-3-(1-ethyl-2-methyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)-2-phenylmethoxyphenyl]-3-(1-ethyl-2-methylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[2-benzoxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)phthalide Formula: C36H36N2O3 MolecularWeight: 544.68264

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC6=CC=CC=C6)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC6=CC=CC=C6)C

InChI

InChI=1S/C36H36N2O3/c1-5-37(6-2)27-21-22-31(33(23-27)40-24-26-15-9-8-10-16-26)36(30-19-13-11-17-28(30)35(39)41-36)34-25(4)38(7-3)32-20-14-12-18-29(32)34/h8-23H,5-7,24H2,1-4H3