4-[2-[2-(dimethylamino)phenyl]ethynyl]-3-(2-phenyl-1-benzofuran-3-yl)isochromen-1-one

Systemtic Name: 4-[2-[2-(dimethylamino)phenyl]ethynyl]-3-(2-phenyl-1-benzofuran-3-yl)isochromen-1-one Openeye Name: 4-[2-[2-(dimethylamino)phenyl]ethynyl]-3-(2-phenylbenzofuran-3-yl)isochromen-1-one CAS Name: 4-[2-[2-(dimethylamino)phenyl]ethynyl]-3-(2-phenyl-3-benzofuranyl)-2-benzopyran-1-one IUPAC Name: 4-[2-[2-(dimethylamino)phenyl]ethynyl]-3-(2-phenyl-1-benzofuran-3-yl)isochromen-1-one Traditional Name: 4-[2-[2-(dimethylamino)phenyl]ethynyl]-3-(2-phenylbenzofuran-3-yl)isocoumarin Formula: C33H23NO3 MolecularWeight: 481.54062

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=C1C#CC2=C(OC(=O)C3=CC=CC=C32)C4=C(OC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CN(C)C1=CC=CC=C1C#CC2=C(OC(=O)C3=CC=CC=C32)C4=C(OC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C33H23NO3/c1-34(2)28-18-10-6-12-22(28)20-21-25-24-15-7-8-16-26(24)33(35)37-32(25)30-27-17-9-11-19-29(27)36-31(30)23-13-4-3-5-14-23/h3-19H,1-2H3