[4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-pentylpyrimidin-2-yl)benzoate

Systemtic Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-pentylpyrimidin-2-yl)benzoate Openeye Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-pentylpyrimidin-2-yl)benzoate CAS Name: 4-(5-pentyl-2-pyrimidinyl)benzoic acid [4-(5-propyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-pentylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-amylpyrimidin-2-yl)benzoic acid [4-(5-propylpyrimidin-2-yl)phenyl] ester Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NC=C(C=N4)CCC

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NC=C(C=N4)CCC

InChI

InChI=1S/C29H30N4O2/c1-3-5-6-8-22-19-32-27(33-20-22)23-9-11-25(12-10-23)29(34)35-26-15-13-24(14-16-26)28-30-17-21(7-4-2)18-31-28/h9-20H,3-8H2,1-2H3