1-[2-(2-tert-butylphenoxy)ethanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(2-tert-butylphenoxy)ethanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-(2-tert-butylphenoxy)acetyl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[2-(2-tert-butylphenoxy)-1-oxoethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(2-tert-butylphenoxy)acetyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[2-(2-tert-butylphenoxy)acetyl]-N-(3-pyridylmethyl)isonipecotamide Formula: C24H31N3O3 MolecularWeight: 409.52124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OCC(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C24H31N3O3/c1-24(2,3)20-8-4-5-9-21(20)30-17-22(28)27-13-10-19(11-14-27)23(29)26-16-18-7-6-12-25-15-18/h4-9,12,15,19H,10-11,13-14,16-17H2,1-3H3,(H,26,29)