N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-(1-methylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-(1-methylpiperidin-1-ium-4-yl)ethanamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-(1-methylpiperidin-1-ium-4-yl)acetamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-2-(1-methyl-4-piperidin-1-iumyl)acetamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-(1-methylpiperidin-1-ium-4-yl)acetamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-2-(1-methylpiperidin-1-ium-4-yl)acetamide Formula: C20H32FN3O+2 MolecularWeight: 349.485983

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CC(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3F

Isomeric SMILES

C[NH+]1CCC(CC1)CC(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3F

InChI

InChI=1S/C20H30FN3O/c1-23-11-8-16(9-12-23)13-20(25)22-18-6-4-10-24(15-18)14-17-5-2-3-7-19(17)21/h2-3,5,7,16,18H,4,6,8-15H2,1H3,(H,22,25)/p+2/t18-/m0/s1