(2,2,10,10-tetramethyl-11-pyridin-3-ylcarbonyloxy-undecyl) pyridine-3-carboxylate

Systemtic Name: (2,2,10,10-tetramethyl-11-pyridin-3-ylcarbonyloxy-undecyl) pyridine-3-carboxylate Openeye Name: [2,2,10,10-tetramethyl-11-(pyridine-3-carbonyloxy)undecyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2,2,10,10-tetramethyl-11-[oxo(3-pyridinyl)methoxy]undecyl] ester IUPAC Name: [2,2,10,10-tetramethyl-11-(pyridine-3-carbonyloxy)undecyl] pyridine-3-carboxylate Traditional Name: nicotinic acid (2,2,10,10-tetramethyl-11-nicotinoyloxy-undecyl) ester Formula: C27H38N2O4 MolecularWeight: 454.60162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCCCC(C)(C)COC(=O)C1=CN=CC=C1)COC(=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)(CCCCCCCC(C)(C)COC(=O)C1=CN=CC=C1)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C27H38N2O4/c1-26(2,20-32-24(30)22-12-10-16-28-18-22)14-8-6-5-7-9-15-27(3,4)21-33-25(31)23-13-11-17-29-19-23/h10-13,16-19H,5-9,14-15,20-21H2,1-4H3