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

Systemtic Name: 4-[2-(2-methoxyphenyl)ethynyl]-3-(2-phenyl-1-benzofuran-3-yl)isochromen-1-one Openeye Name: 4-[2-(2-methoxyphenyl)ethynyl]-3-(2-phenylbenzofuran-3-yl)isochromen-1-one CAS Name: 4-[2-(2-methoxyphenyl)ethynyl]-3-(2-phenyl-3-benzofuranyl)-2-benzopyran-1-one IUPAC Name: 4-[2-(2-methoxyphenyl)ethynyl]-3-(2-phenyl-1-benzofuran-3-yl)isochromen-1-one Traditional Name: 4-[2-(2-methoxyphenyl)ethynyl]-3-(2-phenylbenzofuran-3-yl)isocoumarin Formula: C32H20O4 MolecularWeight: 468.4988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C#CC2=C(OC(=O)C3=CC=CC=C32)C4=C(OC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC=C1C#CC2=C(OC(=O)C3=CC=CC=C32)C4=C(OC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C32H20O4/c1-34-27-17-9-5-11-21(27)19-20-24-23-14-6-7-15-25(23)32(33)36-31(24)29-26-16-8-10-18-28(26)35-30(29)22-12-3-2-4-13-22/h2-18H,1H3