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

Systemtic Name: 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-[2-methyl-1-(phenylmethyl)indol-3-yl]-2-benzofuran-1-one Openeye Name: 3-(1-benzyl-2-methyl-indol-3-yl)-3-[4-(diethylamino)-2-ethoxy-phenyl]isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-ethoxyphenyl]-3-[2-methyl-1-(phenylmethyl)-3-indolyl]-1-isobenzofuranone IUPAC Name: 3-(1-benzyl-2-methylindol-3-yl)-3-[4-(diethylamino)-2-ethoxyphenyl]-2-benzofuran-1-one Traditional Name: 3-(1-benzyl-2-methyl-indol-3-yl)-3-[4-(diethylamino)-2-ethoxy-phenyl]phthalide Formula: C36H36N2O3 MolecularWeight: 544.68264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(N(C5=CC=CC=C54)CC6=CC=CC=C6)C)OCC

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(N(C5=CC=CC=C54)CC6=CC=CC=C6)C)OCC

InChI

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