1-(3-chloranyl-4-fluoranyl-phenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)-N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-keto-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]pyrrolidine-3-carboxamide Formula: C19H28ClFN4O2+2 MolecularWeight: 398.902623

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H26ClFN4O2/c1-23-7-9-24(10-8-23)6-2-5-22-19(27)14-11-18(26)25(13-14)15-3-4-17(21)16(20)12-15/h3-4,12,14H,2,5-11,13H2,1H3,(H,22,27)/p+2