4-octoxy-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene

Systemtic Name: 4-octoxy-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene Openeye Name: 4-octoxy-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene CAS Name: 4-octoxy-1-(2-phenylethynyl)-2-prop-1-ynylbenzene IUPAC Name: 4-octoxy-1-(2-phenylethynyl)-2-prop-1-ynylbenzene Traditional Name: 4-octoxy-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene Formula: C25H28O MolecularWeight: 344.48922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C#CC2=CC=CC=C2)C#CC

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C#CC2=CC=CC=C2)C#CC

InChI

InChI=1S/C25H28O/c1-3-5-6-7-8-12-20-26-25-19-18-23(24(21-25)13-4-2)17-16-22-14-10-9-11-15-22/h9-11,14-15,18-19,21H,3,5-8,12,20H2,1-2H3