3-[4-(diethylamino)-2-oxidanyl-phenyl]-3-(1,2-dimethylindol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(diethylamino)-2-oxidanyl-phenyl]-3-(1,2-dimethylindol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[4-(diethylamino)-2-hydroxy-phenyl]-3-(1,2-dimethylindol-3-yl)isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-hydroxyphenyl]-3-(1,2-dimethyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)-2-hydroxyphenyl]-3-(1,2-dimethylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[4-(diethylamino)-2-hydroxy-phenyl]-3-(1,2-dimethylindol-3-yl)phthalide Formula: C28H28N2O3 MolecularWeight: 440.53352

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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)C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C28H28N2O3/c1-5-30(6-2)19-15-16-23(25(31)17-19)28(22-13-9-7-11-20(22)27(32)33-28)26-18(3)29(4)24-14-10-8-12-21(24)26/h7-17,31H,5-6H2,1-4H3