5-decyl-2-[4-[5-methyl-1-(oxan-2-yloxy)heptoxy]phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-[5-methyl-1-(oxan-2-yloxy)heptoxy]phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-(5-methyl-1-tetrahydropyran-2-yloxy-heptoxy)phenyl]pyrimidine CAS Name: 5-decyl-2-[4-[5-methyl-1-(2-oxanyloxy)heptoxy]phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-[5-methyl-1-(oxan-2-yloxy)heptoxy]phenyl]pyrimidine Traditional Name: 5-decyl-2-[4-(5-methyl-1-tetrahydropyran-2-yloxy-heptoxy)phenyl]pyrimidine Formula: C33H52N2O3 MolecularWeight: 524.77758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(CCCC(C)CC)OC3CCCCO3

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(CCCC(C)CC)OC3CCCCO3

InChI

InChI=1S/C33H52N2O3/c1-4-6-7-8-9-10-11-12-17-28-25-34-33(35-26-28)29-20-22-30(23-21-29)37-32(19-15-16-27(3)5-2)38-31-18-13-14-24-36-31/h20-23,25-27,31-32H,4-19,24H2,1-3H3