5-butyl-2-[4-[(4-nonylphenyl)methoxy]phenyl]pyrimidine

Systemtic Name: 5-butyl-2-[4-[(4-nonylphenyl)methoxy]phenyl]pyrimidine Openeye Name: 5-butyl-2-[4-[(4-nonylphenyl)methoxy]phenyl]pyrimidine CAS Name: 5-butyl-2-[4-[(4-nonylphenyl)methoxy]phenyl]pyrimidine IUPAC Name: 5-butyl-2-[4-[(4-nonylphenyl)methoxy]phenyl]pyrimidine Traditional Name: 5-butyl-2-[4-(4-nonylbenzyl)oxyphenyl]pyrimidine Formula: C30H40N2O MolecularWeight: 444.6514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCC

InChI

InChI=1S/C30H40N2O/c1-3-5-7-8-9-10-11-13-25-14-16-26(17-15-25)24-33-29-20-18-28(19-21-29)30-31-22-27(23-32-30)12-6-4-2/h14-23H,3-13,24H2,1-2H3