[4-(5-nonylpyrimidin-2-yl)phenyl] 4-(5-decylpyrimidin-2-yl)benzoate

Systemtic Name: [4-(5-nonylpyrimidin-2-yl)phenyl] 4-(5-decylpyrimidin-2-yl)benzoate Openeye Name: [4-(5-nonylpyrimidin-2-yl)phenyl] 4-(5-decylpyrimidin-2-yl)benzoate CAS Name: 4-(5-decyl-2-pyrimidinyl)benzoic acid [4-(5-nonyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-nonylpyrimidin-2-yl)phenyl] 4-(5-decylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-decylpyrimidin-2-yl)benzoic acid [4-(5-nonylpyrimidin-2-yl)phenyl] ester Formula: C40H52N4O2 MolecularWeight: 620.86648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NC=C(C=N4)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NC=C(C=N4)CCCCCCCCC

InChI

InChI=1S/C40H52N4O2/c1-3-5-7-9-11-13-15-17-19-32-28-41-38(42-29-32)34-20-22-36(23-21-34)40(45)46-37-26-24-35(25-27-37)39-43-30-33(31-44-39)18-16-14-12-10-8-6-4-2/h20-31H,3-19H2,1-2H3