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

Systemtic Name: 5-dodecoxy-2-(4-dodecylphenyl)pyrimidine; 5-dodecoxy-2-(4-pentylphenyl)pyrimidine; 5-dodecoxy-2-(4-undecylphenyl)pyrimidine Openeye Name: 5-dodecoxy-2-(4-dodecylphenyl)pyrimidine; 5-dodecoxy-2-(4-pentylphenyl)pyrimidine; 5-dodecoxy-2-(4-undecylphenyl)pyrimidine CAS Name: 5-dodecoxy-2-(4-dodecylphenyl)pyrimidine; 5-dodecoxy-2-(4-pentylphenyl)pyrimidine; 5-dodecoxy-2-(4-undecylphenyl)pyrimidine IUPAC Name: 5-dodecoxy-2-(4-dodecylphenyl)pyrimidine; 5-dodecoxy-2-(4-pentylphenyl)pyrimidine; 5-dodecoxy-2-(4-undecylphenyl)pyrimidine Traditional Name: 2-(4-amylphenyl)-5-lauryloxy-pyrimidine; 5-lauryloxy-2-(4-laurylphenyl)pyrimidine; 5-lauryloxy-2-(4-undecylphenyl)pyrimidine Formula: C94H152N6O3 MolecularWeight: 1414.25108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCCCCC.CCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC.CCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCCCCC.CCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC.CCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCCCC

InChI

InChI=1S/C34H56N2O.C33H54N2O.C27H42N2O/c1-3-5-7-9-11-13-15-17-19-21-23-31-24-26-32(27-25-31)34-35-29-33(30-36-34)37-28-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-27-36-32-28-34-33(35-29-32)31-25-23-30(24-26-31)22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-8-9-10-11-12-13-15-21-30-26-22-28-27(29-23-26)25-19-17-24(18-20-25)16-14-6-4-2/h24-27,29-30H,3-23,28H2,1-2H3;23-26,28-29H,3-22,27H2,1-2H3;17-20,22-23H,3-16,21H2,1-2H3