2,5-bis[2-(4-heptoxyphenyl)ethynyl]pyrimidine

Systemtic Name: 2,5-bis[2-(4-heptoxyphenyl)ethynyl]pyrimidine Openeye Name: 2,5-bis[2-(4-heptoxyphenyl)ethynyl]pyrimidine CAS Name: 2,5-bis[2-(4-heptoxyphenyl)ethynyl]pyrimidine IUPAC Name: 2,5-bis[2-(4-heptoxyphenyl)ethynyl]pyrimidine Traditional Name: 2,5-bis[2-(4-heptoxyphenyl)ethynyl]pyrimidine Formula: C34H40N2O2 MolecularWeight: 508.6936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C#CC2=CN=C(N=C2)C#CC3=CC=C(C=C3)OCCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C#CC2=CN=C(N=C2)C#CC3=CC=C(C=C3)OCCCCCCC

InChI

InChI=1S/C34H40N2O2/c1-3-5-7-9-11-25-37-32-20-15-29(16-21-32)13-14-31-27-35-34(36-28-31)24-19-30-17-22-33(23-18-30)38-26-12-10-8-6-4-2/h15-18,20-23,27-28H,3-12,25-26H2,1-2H3