(3R)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-N-(2-piperidin-1-ium-1-ylethyl)propanamide

Systemtic Name: (3R)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-N-(2-piperidin-1-ium-1-ylethyl)propanamide Openeye Name: (3R)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-N-(2-piperidin-1-ium-1-ylethyl)propanamide CAS Name: (3R)-3-(3-fluorophenyl)-3-(1-methyl-3-indolyl)-N-[2-(1-piperidin-1-iumyl)ethyl]propanamide IUPAC Name: (3R)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-N-(2-piperidin-1-ium-1-ylethyl)propanamide Traditional Name: (3R)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-N-(2-piperidin-1-ium-1-ylethyl)propionamide Formula: C25H31FN3O+ MolecularWeight: 408.531543

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(CC(=O)NCC[NH+]3CCCCC3)C4=CC(=CC=C4)F

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)[C@H](CC(=O)NCC[NH+]3CCCCC3)C4=CC(=CC=C4)F

InChI

InChI=1S/C25H30FN3O/c1-28-18-23(21-10-3-4-11-24(21)28)22(19-8-7-9-20(26)16-19)17-25(30)27-12-15-29-13-5-2-6-14-29/h3-4,7-11,16,18,22H,2,5-6,12-15,17H2,1H3,(H,27,30)/p+1/t22-/m1/s1