2-[4-(1-oxidanidylpyridin-1-ium-2-yl)piperidin-1-yl]-N-(2-propan-2-yloxyphenyl)ethanamide

Systemtic Name: 2-[4-(1-oxidanidylpyridin-1-ium-2-yl)piperidin-1-yl]-N-(2-propan-2-yloxyphenyl)ethanamide Openeye Name: N-(2-isopropoxyphenyl)-2-[4-(1-oxidopyridin-1-ium-2-yl)-1-piperidyl]acetamide CAS Name: 2-[4-(1-oxido-2-pyridin-1-iumyl)-1-piperidinyl]-N-(2-propan-2-yloxyphenyl)acetamide IUPAC Name: 2-[4-(1-oxidopyridin-1-ium-2-yl)piperidin-1-yl]-N-(2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxyphenyl)-2-[4-(1-oxidopyridin-1-ium-2-yl)piperidino]acetamide Formula: C21H27N3O3 MolecularWeight: 369.45738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1NC(=O)CN2CCC(CC2)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC(C)OC1=CC=CC=C1NC(=O)CN2CCC(CC2)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C21H27N3O3/c1-16(2)27-20-9-4-3-7-18(20)22-21(25)15-23-13-10-17(11-14-23)19-8-5-6-12-24(19)26/h3-9,12,16-17H,10-11,13-15H2,1-2H3,(H,22,25)