2-[9,9-dihexyl-7-(5-phenylpyrimidin-2-yl)fluoren-2-yl]-5-phenyl-pyrimidine

Systemtic Name: 2-[9,9-dihexyl-7-(5-phenylpyrimidin-2-yl)fluoren-2-yl]-5-phenyl-pyrimidine Openeye Name: 2-[9,9-dihexyl-7-(5-phenylpyrimidin-2-yl)fluoren-2-yl]-5-phenyl-pyrimidine CAS Name: 2-[9,9-dihexyl-7-(5-phenyl-2-pyrimidinyl)-2-fluorenyl]-5-phenylpyrimidine IUPAC Name: 2-[9,9-dihexyl-7-(5-phenylpyrimidin-2-yl)fluoren-2-yl]-5-phenylpyrimidine Traditional Name: 2-[9,9-dihexyl-7-(5-phenylpyrimidin-2-yl)fluoren-2-yl]-5-phenyl-pyrimidine Formula: C45H46N4 MolecularWeight: 642.87354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C2=C(C=CC(=C2)C3=NC=C(C=N3)C4=CC=CC=C4)C5=C1C=C(C=C5)C6=NC=C(C=N6)C7=CC=CC=C7)CCCCCC

Isomeric SMILES

CCCCCCC1(C2=C(C=CC(=C2)C3=NC=C(C=N3)C4=CC=CC=C4)C5=C1C=C(C=C5)C6=NC=C(C=N6)C7=CC=CC=C7)CCCCCC

InChI

InChI=1S/C45H46N4/c1-3-5-7-15-25-45(26-16-8-6-4-2)41-27-35(43-46-29-37(30-47-43)33-17-11-9-12-18-33)21-23-39(41)40-24-22-36(28-42(40)45)44-48-31-38(32-49-44)34-19-13-10-14-20-34/h9-14,17-24,27-32H,3-8,15-16,25-26H2,1-2H3