1-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C20H29N4O2+ MolecularWeight: 357.46986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=NOC(=N1)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2/c1-2-3-9-18-22-19(26-23-18)15-24-12-10-17(11-13-24)20(25)21-14-16-7-5-4-6-8-16/h4-8,17H,2-3,9-15H2,1H3,(H,21,25)/p+1