2-(4-dodecylphenyl)-5-nonoxy-pyrimidine; 5-nonoxy-2-(4-pentylphenyl)pyrimidine; 5-nonoxy-2-(4-undecylphenyl)pyrimidine

Systemtic Name: 2-(4-dodecylphenyl)-5-nonoxy-pyrimidine; 5-nonoxy-2-(4-pentylphenyl)pyrimidine; 5-nonoxy-2-(4-undecylphenyl)pyrimidine Openeye Name: 2-(4-dodecylphenyl)-5-nonoxy-pyrimidine; 5-nonoxy-2-(4-pentylphenyl)pyrimidine; 5-nonoxy-2-(4-undecylphenyl)pyrimidine CAS Name: 2-(4-dodecylphenyl)-5-nonoxypyrimidine; 5-nonoxy-2-(4-pentylphenyl)pyrimidine; 5-nonoxy-2-(4-undecylphenyl)pyrimidine IUPAC Name: 2-(4-dodecylphenyl)-5-nonoxypyrimidine; 5-nonoxy-2-(4-pentylphenyl)pyrimidine; 5-nonoxy-2-(4-undecylphenyl)pyrimidine Traditional Name: 2-(4-amylphenyl)-5-nonoxy-pyrimidine; 2-(4-laurylphenyl)-5-nonoxy-pyrimidine; 5-nonoxy-2-(4-undecylphenyl)pyrimidine Formula: C85H134N6O3 MolecularWeight: 1288.01186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCC.CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCC.CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCC.CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCC.CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C31H50N2O.C30H48N2O.C24H36N2O/c1-3-5-7-9-11-12-13-14-16-18-20-28-21-23-29(24-22-28)31-32-26-30(27-33-31)34-25-19-17-15-10-8-6-4-2;1-3-5-7-9-11-12-13-15-17-19-27-20-22-28(23-21-27)30-31-25-29(26-32-30)33-24-18-16-14-10-8-6-4-2;1-3-5-7-8-9-10-12-18-27-23-19-25-24(26-20-23)22-16-14-21(15-17-22)13-11-6-4-2/h21-24,26-27H,3-20,25H2,1-2H3;20-23,25-26H,3-19,24H2,1-2H3;14-17,19-20H,3-13,18H2,1-2H3