N-(1,3-benzodioxol-5-yl)-1-(2-pyrazol-1-ylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(2-pyrazol-1-ylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(2-pyrazol-1-ylbenzoyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[oxo-[2-(1-pyrazolyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(2-pyrazol-1-ylbenzoyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(2-pyrazol-1-ylbenzoyl)isonipecotamide Formula: C23H22N4O4 MolecularWeight: 418.44518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4N5C=CC=N5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4N5C=CC=N5

InChI

InChI=1S/C23H22N4O4/c28-22(25-17-6-7-20-21(14-17)31-15-30-20)16-8-12-26(13-9-16)23(29)18-4-1-2-5-19(18)27-11-3-10-24-27/h1-7,10-11,14,16H,8-9,12-13,15H2,(H,25,28)