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

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-morpholin-4-yl-benzamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-morpholino-benzamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-3-(4-morpholinyl)benzamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-morpholin-4-ylbenzamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-3-morpholino-benzamide Formula: C23H29FN3O2+ MolecularWeight: 398.493663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=C2F)NC(=O)C3=CC(=CC=C3)N4CCOCC4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=C2F)NC(=O)C3=CC(=CC=C3)N4CCOCC4

InChI

InChI=1S/C23H28FN3O2/c24-22-9-2-1-5-19(22)16-26-10-4-7-20(17-26)25-23(28)18-6-3-8-21(15-18)27-11-13-29-14-12-27/h1-3,5-6,8-9,15,20H,4,7,10-14,16-17H2,(H,25,28)/p+1/t20-/m0/s1