N-(4-fluoranyl-2-methyl-phenyl)-3-[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-(4-fluoranyl-2-methyl-phenyl)-3-[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: N-(4-fluoro-2-methyl-phenyl)-3-[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]propanamide CAS Name: N-(4-fluoro-2-methylphenyl)-3-[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-(4-fluoro-2-methylphenyl)-3-[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: N-(4-fluoro-2-methyl-phenyl)-3-[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]propionamide Formula: C25H31FN3O+ MolecularWeight: 408.531543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)CCC2CCC[NH+](C2)CC3=C(C4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)CC[C@H]2CCC[NH+](C2)CC3=C(C4=CC=CC=C4N3)C

InChI

InChI=1S/C25H30FN3O/c1-17-14-20(26)10-11-22(17)28-25(30)12-9-19-6-5-13-29(15-19)16-24-18(2)21-7-3-4-8-23(21)27-24/h3-4,7-8,10-11,14,19,27H,5-6,9,12-13,15-16H2,1-2H3,(H,28,30)/p+1/t19-/m1/s1