5-heptyl-2-[4-[4-(2-methyl-3-octoxy-propoxy)phenyl]phenyl]pyrimidine

Systemtic Name: 5-heptyl-2-[4-[4-(2-methyl-3-octoxy-propoxy)phenyl]phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-[4-(2-methyl-3-octoxy-propoxy)phenyl]phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-[4-(2-methyl-3-octoxypropoxy)phenyl]phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-[4-(2-methyl-3-octoxypropoxy)phenyl]phenyl]pyrimidine Traditional Name: 5-heptyl-2-[4-[4-(2-methyl-3-octoxy-propoxy)phenyl]phenyl]pyrimidine Formula: C35H50N2O2 MolecularWeight: 530.7837

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(C)COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCCC

Isomeric SMILES

CCCCCCCCOCC(C)COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCCC

InChI

InChI=1S/C35H50N2O2/c1-4-6-8-10-12-14-24-38-27-29(3)28-39-34-22-20-32(21-23-34)31-16-18-33(19-17-31)35-36-25-30(26-37-35)15-13-11-9-7-5-2/h16-23,25-26,29H,4-15,24,27-28H2,1-3H3