[2-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]oxy-3-pyridin-3-ylcarbonyloxy-propyl] pyridine-3-carboxylate

Systemtic Name: [2-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]oxy-3-pyridin-3-ylcarbonyloxy-propyl] pyridine-3-carboxylate Openeye Name: [2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-3-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]-3-[oxo(3-pyridinyl)methoxy]propyl] ester IUPAC Name: [2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-3-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-3-nicotinoyloxy-propyl] ester Formula: C25H23ClN2O7 MolecularWeight: 498.91232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC(COC(=O)C1=CN=CC=C1)COC(=O)C2=CN=CC=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)OC(COC(=O)C1=CN=CC=C1)COC(=O)C2=CN=CC=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H23ClN2O7/c1-25(2,35-20-9-7-19(26)8-10-20)24(31)34-21(15-32-22(29)17-5-3-11-27-13-17)16-33-23(30)18-6-4-12-28-14-18/h3-14,21H,15-16H2,1-2H3