(2-tert-butyl-4-cyclohexyl-phenyl) pyridine-3-carboxylate

Systemtic Name: (2-tert-butyl-4-cyclohexyl-phenyl) pyridine-3-carboxylate Openeye Name: (2-tert-butyl-4-cyclohexyl-phenyl) pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid (2-tert-butyl-4-cyclohexylphenyl) ester IUPAC Name: (2-tert-butyl-4-cyclohexylphenyl) pyridine-3-carboxylate Traditional Name: nicotinic acid (2-tert-butyl-4-cyclohexyl-phenyl) ester Formula: C22H27NO2 MolecularWeight: 337.45528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2CCCCC2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2CCCCC2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H27NO2/c1-22(2,3)19-14-17(16-8-5-4-6-9-16)11-12-20(19)25-21(24)18-10-7-13-23-15-18/h7,10-16H,4-6,8-9H2,1-3H3