3-methoxy-4-octoxy-5-(2-pyridin-4-ylethynyl)benzaldehyde

Systemtic Name: 3-methoxy-4-octoxy-5-(2-pyridin-4-ylethynyl)benzaldehyde Openeye Name: 3-methoxy-4-octoxy-5-[2-(4-pyridyl)ethynyl]benzaldehyde CAS Name: 3-methoxy-4-octoxy-5-(2-pyridin-4-ylethynyl)benzaldehyde IUPAC Name: 3-methoxy-4-octoxy-5-(2-pyridin-4-ylethynyl)benzaldehyde Traditional Name: 3-methoxy-4-octoxy-5-[2-(4-pyridyl)ethynyl]benzaldehyde Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1C#CC2=CC=NC=C2)C=O)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1C#CC2=CC=NC=C2)C=O)OC

InChI

InChI=1S/C23H27NO3/c1-3-4-5-6-7-8-15-27-23-21(10-9-19-11-13-24-14-12-19)16-20(18-25)17-22(23)26-2/h11-14,16-18H,3-8,15H2,1-2H3