4,6-bis[(E)-2-[4-(4-octoxyphenyl)phenyl]ethenyl]pyrimidine

Systemtic Name: 4,6-bis[(E)-2-[4-(4-octoxyphenyl)phenyl]ethenyl]pyrimidine Openeye Name: 4,6-bis[(E)-2-[4-(4-octoxyphenyl)phenyl]vinyl]pyrimidine CAS Name: 4,6-bis[(E)-2-[4-(4-octoxyphenyl)phenyl]ethenyl]pyrimidine IUPAC Name: 4,6-bis[(E)-2-[4-(4-octoxyphenyl)phenyl]ethenyl]pyrimidine Traditional Name: 4,6-bis[(E)-2-[4-(4-octoxyphenyl)phenyl]vinyl]pyrimidine Formula: C48H56N2O2 MolecularWeight: 692.97044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C=CC3=CC(=NC=N3)C=CC4=CC=C(C=C4)C5=CC=C(C=C5)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)/C=C/C3=CC(=NC=N3)/C=C/C4=CC=C(C=C4)C5=CC=C(C=C5)OCCCCCCCC

InChI

InChI=1S/C48H56N2O2/c1-3-5-7-9-11-13-35-51-47-31-25-43(26-32-47)41-21-15-39(16-22-41)19-29-45-37-46(50-38-49-45)30-20-40-17-23-42(24-18-40)44-27-33-48(34-28-44)52-36-14-12-10-8-6-4-2/h15-34,37-38H,3-14,35-36H2,1-2H3/b29-19+,30-20+