N-[2-[1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[1-[(2-butyl-1H-imidazol-5-yl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-2-phenylacetamide IUPAC Name: N-[2-[1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenylacetamide Traditional Name: N-[2-[1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-acetamide Formula: C24H33N6O+ MolecularWeight: 421.55842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC=C(N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H32N6O/c1-2-3-9-22-25-17-20(27-22)18-29-14-11-21(12-15-29)30-23(10-13-26-30)28-24(31)16-19-7-5-4-6-8-19/h4-8,10,13,17,21H,2-3,9,11-12,14-16,18H2,1H3,(H,25,27)(H,28,31)/p+1