[3-[[4-(5-pentylpyridin-2-yl)phenyl]carbonylamino]phenyl] 4-(5-pentylpyridin-2-yl)benzoate

Systemtic Name: [3-[[4-(5-pentylpyridin-2-yl)phenyl]carbonylamino]phenyl] 4-(5-pentylpyridin-2-yl)benzoate Openeye Name: [3-[[4-(5-pentyl-2-pyridyl)benzoyl]amino]phenyl] 4-(5-pentyl-2-pyridyl)benzoate CAS Name: 4-(5-pentyl-2-pyridinyl)benzoic acid [3-[[oxo-[4-(5-pentyl-2-pyridinyl)phenyl]methyl]amino]phenyl] ester IUPAC Name: [3-[[4-(5-pentylpyridin-2-yl)benzoyl]amino]phenyl] 4-(5-pentylpyridin-2-yl)benzoate Traditional Name: 4-(5-amyl-2-pyridyl)benzoic acid [3-[[4-(5-amyl-2-pyridyl)benzoyl]amino]phenyl] ester Formula: C40H41N3O3 MolecularWeight: 611.77184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)OC(=O)C4=CC=C(C=C4)C5=NC=C(C=C5)CCCCC

Isomeric SMILES

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)OC(=O)C4=CC=C(C=C4)C5=NC=C(C=C5)CCCCC

InChI

InChI=1S/C40H41N3O3/c1-3-5-7-10-29-14-24-37(41-27-29)31-16-20-33(21-17-31)39(44)43-35-12-9-13-36(26-35)46-40(45)34-22-18-32(19-23-34)38-25-15-30(28-42-38)11-8-6-4-2/h9,12-28H,3-8,10-11H2,1-2H3,(H,43,44)