5-decyl-2-[4-[3-methyl-2-(oxan-2-yloxy)pentoxy]phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-[3-methyl-2-(oxan-2-yloxy)pentoxy]phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-(3-methyl-2-tetrahydropyran-2-yloxy-pentoxy)phenyl]pyrimidine CAS Name: 5-decyl-2-[4-[3-methyl-2-(2-oxanyloxy)pentoxy]phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-[3-methyl-2-(oxan-2-yloxy)pentoxy]phenyl]pyrimidine Traditional Name: 5-decyl-2-[4-(3-methyl-2-tetrahydropyran-2-yloxy-pentoxy)phenyl]pyrimidine Formula: C31H48N2O3 MolecularWeight: 496.72442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C(C)CC)OC3CCCCO3

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C(C)CC)OC3CCCCO3

InChI

InChI=1S/C31H48N2O3/c1-4-6-7-8-9-10-11-12-15-26-22-32-31(33-23-26)27-17-19-28(20-18-27)35-24-29(25(3)5-2)36-30-16-13-14-21-34-30/h17-20,22-23,25,29-30H,4-16,21,24H2,1-3H3