N-(3-fluorophenyl)-2-[4-[(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-[(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-[(1R)-2-morpholino-2-oxo-1-phenyl-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[(1R)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-[(1R)-2-keto-2-morpholino-1-phenyl-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C24H30FN4O3+ MolecularWeight: 441.518403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(C3=CC=CC=C3)C(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)[C@H](C3=CC=CC=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C24H29FN4O3/c25-20-7-4-8-21(17-20)26-22(30)18-27-9-11-28(12-10-27)23(19-5-2-1-3-6-19)24(31)29-13-15-32-16-14-29/h1-8,17,23H,9-16,18H2,(H,26,30)/p+1/t23-/m1/s1