2-(2-decyl-2,3-dihydro-1-benzofuran-5-yl)-5-undecyl-pyrimidine

Systemtic Name: 2-(2-decyl-2,3-dihydro-1-benzofuran-5-yl)-5-undecyl-pyrimidine Openeye Name: 2-(2-decyl-2,3-dihydrobenzofuran-5-yl)-5-undecyl-pyrimidine CAS Name: 2-(2-decyl-2,3-dihydrobenzofuran-5-yl)-5-undecylpyrimidine IUPAC Name: 2-(2-decyl-2,3-dihydro-1-benzofuran-5-yl)-5-undecylpyrimidine Traditional Name: 2-(2-decylcoumaran-5-yl)-5-undecyl-pyrimidine Formula: C33H52N2O MolecularWeight: 492.77878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC3=C(C=C2)OC(C3)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC3=C(C=C2)OC(C3)CCCCCCCCCC

InChI

InChI=1S/C33H52N2O/c1-3-5-7-9-11-13-14-16-18-20-28-26-34-33(35-27-28)29-22-23-32-30(24-29)25-31(36-32)21-19-17-15-12-10-8-6-4-2/h22-24,26-27,31H,3-21,25H2,1-2H3