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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCCC(C2)NC(=O)CCC3=CC=CC=C3F

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)NC(=O)CCC3=CC=CC=C3F

InChI

InChI=1S/C20H30FN3O/c1-23-13-10-18(11-14-23)24-12-4-6-17(15-24)22-20(25)9-8-16-5-2-3-7-19(16)21/h2-3,5,7,17-18H,4,6,8-15H2,1H3,(H,22,25)/p+2/t17-/m0/s1