(3R)-1-(4-fluorophenyl)-5-oxidanylidene-N-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(4-fluorophenyl)-5-oxidanylidene-N-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(4-fluorophenyl)-5-oxo-N-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide CAS Name: (3R)-1-(4-fluorophenyl)-5-oxo-N-[3-oxo-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]propyl]-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(4-fluorophenyl)-5-oxo-N-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide Traditional Name: (3R)-1-(4-fluorophenyl)-5-keto-N-[3-keto-3-(4-pyridin-1-ium-2-ylpiperazino)propyl]pyrrolidine-3-carboxamide Formula: C23H27FN5O3+ MolecularWeight: 440.490583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCNC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCNC(=O)[C@@H]3CC(=O)N(C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN5O3/c24-18-4-6-19(7-5-18)29-16-17(15-22(29)31)23(32)26-10-8-21(30)28-13-11-27(12-14-28)20-3-1-2-9-25-20/h1-7,9,17H,8,10-16H2,(H,26,32)/p+1/t17-/m1/s1