1-[2,3-dimethoxy-5-[(2-methylphenyl)methyl]phenyl]-3-(4-methylpyridin-2-yl)propane-1,3-dione

Systemtic Name: 1-[2,3-dimethoxy-5-[(2-methylphenyl)methyl]phenyl]-3-(4-methylpyridin-2-yl)propane-1,3-dione Openeye Name: 1-[2,3-dimethoxy-5-(o-tolylmethyl)phenyl]-3-(4-methyl-2-pyridyl)propane-1,3-dione CAS Name: 1-[2,3-dimethoxy-5-[(2-methylphenyl)methyl]phenyl]-3-(4-methyl-2-pyridinyl)propane-1,3-dione IUPAC Name: 1-[2,3-dimethoxy-5-[(2-methylphenyl)methyl]phenyl]-3-(4-methylpyridin-2-yl)propane-1,3-dione Traditional Name: 1-[2,3-dimethoxy-5-(2-methylbenzyl)phenyl]-3-(4-methyl-2-pyridyl)propane-1,3-dione Formula: C25H25NO4 MolecularWeight: 403.4703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)CC(=O)C2=CC(=CC(=C2OC)OC)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)CC(=O)C2=CC(=CC(=C2OC)OC)CC3=CC=CC=C3C

InChI

InChI=1S/C25H25NO4/c1-16-9-10-26-21(11-16)23(28)15-22(27)20-13-18(14-24(29-3)25(20)30-4)12-19-8-6-5-7-17(19)2/h5-11,13-14H,12,15H2,1-4H3