3-[(3S,4R)-1-(2,3-dihydro-1H-inden-2-yl)-4-[4-(2-fluorophenyl)piperazin-1-yl]piperidin-1-ium-3-yl]-N-methyl-propanamide

Systemtic Name: 3-[(3S,4R)-1-(2,3-dihydro-1H-inden-2-yl)-4-[4-(2-fluorophenyl)piperazin-1-yl]piperidin-1-ium-3-yl]-N-methyl-propanamide Openeye Name: 3-[(3S,4R)-4-[4-(2-fluorophenyl)piperazin-1-yl]-1-indan-2-yl-piperidin-1-ium-3-yl]-N-methyl-propanamide CAS Name: 3-[(3S,4R)-1-(2,3-dihydro-1H-inden-2-yl)-4-[4-(2-fluorophenyl)-1-piperazinyl]-3-piperidin-1-iumyl]-N-methylpropanamide IUPAC Name: 3-[(3S,4R)-1-(2,3-dihydro-1H-inden-2-yl)-4-[4-(2-fluorophenyl)piperazin-1-yl]piperidin-1-ium-3-yl]-N-methylpropanamide Traditional Name: 3-[(3S,4R)-4-[4-(2-fluorophenyl)piperazino]-1-indan-2-yl-piperidin-1-ium-3-yl]-N-methyl-propionamide Formula: C28H38FN4O+ MolecularWeight: 465.625923

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCC1C[NH+](CCC1N2CCN(CC2)C3=CC=CC=C3F)C4CC5=CC=CC=C5C4

Isomeric SMILES

CNC(=O)CC[C@H]1C[NH+](CC[C@H]1N2CCN(CC2)C3=CC=CC=C3F)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C28H37FN4O/c1-30-28(34)11-10-23-20-33(24-18-21-6-2-3-7-22(21)19-24)13-12-26(23)31-14-16-32(17-15-31)27-9-5-4-8-25(27)29/h2-9,23-24,26H,10-20H2,1H3,(H,30,34)/p+1/t23-,26+/m0/s1