1-[1-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-(3-fluoro-4-methoxy-benzoyl)-4-piperidyl]-N-isopropyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(3-fluoro-4-methoxyphenyl)-oxomethyl]-4-piperidinyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-(3-fluoro-4-methoxybenzoyl)piperidin-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[1-(3-fluoro-4-methoxy-benzoyl)-4-piperidyl]-N-isopropyl-piperidin-1-ium-4-carboxamide Formula: C22H33FN3O3+ MolecularWeight: 406.514123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C22H32FN3O3/c1-15(2)24-21(27)16-6-10-25(11-7-16)18-8-12-26(13-9-18)22(28)17-4-5-20(29-3)19(23)14-17/h4-5,14-16,18H,6-13H2,1-3H3,(H,24,27)/p+1