2-chloranyl-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[(2S)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]nicotinamide Formula: C18H20ClFN3O2+ MolecularWeight: 364.821703

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=C(N=CC=C2)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2=C(N=CC=C2)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H19ClFN3O2/c19-17-15(2-1-7-21-17)18(24)22-12-16(23-8-10-25-11-9-23)13-3-5-14(20)6-4-13/h1-7,16H,8-12H2,(H,22,24)/p+1/t16-/m1/s1