[2-methyl-3-oxidanyl-5-[2-[3-(phenylcarbonyl)phenyl]propanoyloxymethyl]pyridin-4-yl]methyl 5-methylpyridine-3-carboxylate

Systemtic Name: [2-methyl-3-oxidanyl-5-[2-[3-(phenylcarbonyl)phenyl]propanoyloxymethyl]pyridin-4-yl]methyl 5-methylpyridine-3-carboxylate Openeye Name: [5-[2-(3-benzoylphenyl)propanoyloxymethyl]-3-hydroxy-2-methyl-4-pyridyl]methyl 5-methylpyridine-3-carboxylate CAS Name: 5-methyl-3-pyridinecarboxylic acid [5-[[2-(3-benzoylphenyl)-1-oxopropoxy]methyl]-3-hydroxy-2-methyl-4-pyridinyl]methyl ester IUPAC Name: [5-[2-(3-benzoylphenyl)propanoyloxymethyl]-3-hydroxy-2-methylpyridin-4-yl]methyl 5-methylpyridine-3-carboxylate Traditional Name: 5-methylnicotinic acid [5-[2-(3-benzoylphenyl)propanoyloxymethyl]-3-hydroxy-2-methyl-4-pyridyl]methyl ester Formula: C31H28N2O6 MolecularWeight: 524.56382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CC(=C1)C(=O)OCC2=C(C(=NC=C2COC(=O)C(C)C3=CC=CC(=C3)C(=O)C4=CC=CC=C4)C)O

Isomeric SMILES

CC1=CN=CC(=C1)C(=O)OCC2=C(C(=NC=C2COC(=O)C(C)C3=CC=CC(=C3)C(=O)C4=CC=CC=C4)C)O

InChI

InChI=1S/C31H28N2O6/c1-19-12-25(15-32-14-19)31(37)39-18-27-26(16-33-21(3)28(27)34)17-38-30(36)20(2)23-10-7-11-24(13-23)29(35)22-8-5-4-6-9-22/h4-16,20,34H,17-18H2,1-3H3