N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: 1-(1H-imidazol-5-ylsulfonyl)-N-piperonyl-isonipecotamide Formula: C17H20N4O5S MolecularWeight: 392.4295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CN=CN4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CN=CN4

InChI

InChI=1S/C17H20N4O5S/c22-17(19-8-12-1-2-14-15(7-12)26-11-25-14)13-3-5-21(6-4-13)27(23,24)16-9-18-10-20-16/h1-2,7,9-10,13H,3-6,8,11H2,(H,18,20)(H,19,22)