1,5-bis(4-methoxyphenyl)-3-(2-phenylethynyl)pentane-1,5-dione

Systemtic Name: 1,5-bis(4-methoxyphenyl)-3-(2-phenylethynyl)pentane-1,5-dione Openeye Name: 1,5-bis(4-methoxyphenyl)-3-(2-phenylethynyl)pentane-1,5-dione CAS Name: 1,5-bis(4-methoxyphenyl)-3-(2-phenylethynyl)pentane-1,5-dione IUPAC Name: 1,5-bis(4-methoxyphenyl)-3-(2-phenylethynyl)pentane-1,5-dione Traditional Name: 1,5-bis(4-methoxyphenyl)-3-(2-phenylethynyl)pentane-1,5-dione Formula: C27H24O4 MolecularWeight: 412.47706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC(CC(=O)C2=CC=C(C=C2)OC)C#CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC(CC(=O)C2=CC=C(C=C2)OC)C#CC3=CC=CC=C3

InChI

InChI=1S/C27H24O4/c1-30-24-14-10-22(11-15-24)26(28)18-21(9-8-20-6-4-3-5-7-20)19-27(29)23-12-16-25(31-2)17-13-23/h3-7,10-17,21H,18-19H2,1-2H3