5-nonoxy-2-(4-octan-2-yloxyphenyl)pyrimidine

Systemtic Name: 5-nonoxy-2-(4-octan-2-yloxyphenyl)pyrimidine Openeye Name: 2-[4-(1-methylheptoxy)phenyl]-5-nonoxy-pyrimidine CAS Name: 5-nonoxy-2-(4-octan-2-yloxyphenyl)pyrimidine IUPAC Name: 5-nonoxy-2-(4-octan-2-yloxyphenyl)pyrimidine Traditional Name: 2-[4-(1-methylheptoxy)phenyl]-5-nonoxy-pyrimidine Formula: C27H42N2O2 MolecularWeight: 426.63458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(C)CCCCCC

InChI

InChI=1S/C27H42N2O2/c1-4-6-8-10-11-12-14-20-30-26-21-28-27(29-22-26)24-16-18-25(19-17-24)31-23(3)15-13-9-7-5-2/h16-19,21-23H,4-15,20H2,1-3H3