1-(4-methylpyridin-2-yl)-3-[5-(phenylmethyl)-2-pyridin-2-yloxy-phenyl]propane-1,3-dione

Systemtic Name: 1-(4-methylpyridin-2-yl)-3-[5-(phenylmethyl)-2-pyridin-2-yloxy-phenyl]propane-1,3-dione Openeye Name: 1-[5-benzyl-2-(2-pyridyloxy)phenyl]-3-(4-methyl-2-pyridyl)propane-1,3-dione CAS Name: 1-(4-methyl-2-pyridinyl)-3-[5-(phenylmethyl)-2-(2-pyridinyloxy)phenyl]propane-1,3-dione IUPAC Name: 1-(5-benzyl-2-pyridin-2-yloxyphenyl)-3-(4-methylpyridin-2-yl)propane-1,3-dione Traditional Name: 1-[5-benzyl-2-(2-pyridyloxy)phenyl]-3-(4-methyl-2-pyridyl)propane-1,3-dione Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)CC(=O)C2=C(C=CC(=C2)CC3=CC=CC=C3)OC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)CC(=O)C2=C(C=CC(=C2)CC3=CC=CC=C3)OC4=CC=CC=N4

InChI

InChI=1S/C27H22N2O3/c1-19-12-14-28-23(15-19)25(31)18-24(30)22-17-21(16-20-7-3-2-4-8-20)10-11-26(22)32-27-9-5-6-13-29-27/h2-15,17H,16,18H2,1H3