2-[(2R)-1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(2R)-1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-propan-2-yl-ethanamide Openeye Name: 2-[(2R)-1-[(2-chloro-4-fluoro-phenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-isopropyl-N-methyl-acetamide CAS Name: 2-[(2R)-1-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-propan-2-ylacetamide IUPAC Name: 2-[(2R)-1-[(2-chloro-4-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-propan-2-ylacetamide Traditional Name: 2-[(2R)-1-(2-chloro-4-fluoro-benzyl)-3-keto-piperazin-1-ium-2-yl]-N-isopropyl-N-methyl-acetamide Formula: C17H24ClFN3O2+ MolecularWeight: 356.842763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C(=O)CC1C(=O)NCC[NH+]1CC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC(C)N(C)C(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C17H23ClFN3O2/c1-11(2)21(3)16(23)9-15-17(24)20-6-7-22(15)10-12-4-5-13(19)8-14(12)18/h4-5,8,11,15H,6-7,9-10H2,1-3H3,(H,20,24)/p+1/t15-/m1/s1