5-heptyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine

Systemtic Name: 5-heptyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine Traditional Name: 2-[4-(4-amylbenzyl)oxyphenyl]-5-heptyl-pyrimidine Formula: C29H38N2O MolecularWeight: 430.62482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C29H38N2O/c1-3-5-7-8-10-12-26-21-30-29(31-22-26)27-17-19-28(20-18-27)32-23-25-15-13-24(14-16-25)11-9-6-4-2/h13-22H,3-12,23H2,1-2H3