5-(5-dodecylpyrimidin-2-yl)-2-(4-octylphenyl)-1,3-benzoxazole

Systemtic Name: 5-(5-dodecylpyrimidin-2-yl)-2-(4-octylphenyl)-1,3-benzoxazole Openeye Name: 5-(5-dodecylpyrimidin-2-yl)-2-(4-octylphenyl)-1,3-benzoxazole CAS Name: 5-(5-dodecyl-2-pyrimidinyl)-2-(4-octylphenyl)-1,3-benzoxazole IUPAC Name: 5-(5-dodecylpyrimidin-2-yl)-2-(4-octylphenyl)-1,3-benzoxazole Traditional Name: 5-(5-laurylpyrimidin-2-yl)-2-(4-octylphenyl)-1,3-benzoxazole Formula: C37H51N3O MolecularWeight: 553.82034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)CCCCCCCC

InChI

InChI=1S/C37H51N3O/c1-3-5-7-9-11-12-13-14-16-18-20-31-28-38-36(39-29-31)33-25-26-35-34(27-33)40-37(41-35)32-23-21-30(22-24-32)19-17-15-10-8-6-4-2/h21-29H,3-20H2,1-2H3