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

Systemtic Name: 5-nonyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine Openeye Name: 5-nonyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine CAS Name: 5-nonyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine IUPAC Name: 5-nonyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine Traditional Name: 2-[4-(4-amylbenzyl)oxyphenyl]-5-nonyl-pyrimidine Formula: C31H42N2O MolecularWeight: 458.67798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C31H42N2O/c1-3-5-7-8-9-10-12-14-28-23-32-31(33-24-28)29-19-21-30(22-20-29)34-25-27-17-15-26(16-18-27)13-11-6-4-2/h15-24H,3-14,25H2,1-2H3