3-[4-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 3-[4-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-[4-[(3-fluorophenyl)methyl]-3-oxo-piperazine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-[[4-[(3-fluorophenyl)methyl]-3-oxo-1-piperazinyl]-oxomethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 3-[4-[(3-fluorophenyl)methyl]-3-oxopiperazine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-[4-(3-fluorobenzyl)-3-keto-piperazine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C20H18FN4O3+ MolecularWeight: 381.380323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C(=O)C2=CNC3=CC=CC=[N+]3C2=O)CC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(C(=O)CN1C(=O)C2=CNC3=CC=CC=[N+]3C2=O)CC4=CC(=CC=C4)F

InChI

InChI=1S/C20H17FN4O3/c21-15-5-3-4-14(10-15)12-23-8-9-24(13-18(23)26)19(27)16-11-22-17-6-1-2-7-25(17)20(16)28/h1-7,10-11H,8-9,12-13H2/p+1