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

Systemtic Name: 5-pentyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine Openeye Name: 5-pentyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine CAS Name: 5-pentyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine IUPAC Name: 5-pentyl-2-[4-[(4-pentylphenyl)methoxy]phenyl]pyrimidine Traditional Name: 5-amyl-2-[4-(4-amylbenzyl)oxyphenyl]pyrimidine Formula: C27H34N2O MolecularWeight: 402.57166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCCC

InChI

InChI=1S/C27H34N2O/c1-3-5-7-9-22-11-13-23(14-12-22)21-30-26-17-15-25(16-18-26)27-28-19-24(20-29-27)10-8-6-4-2/h11-20H,3-10,21H2,1-2H3