2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C15H20N4O3+2 MolecularWeight: 304.3443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=C(C(=O)[N+]3=CC=CC=C3N2)C=O

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=C(C(=O)[N+]3=CC=CC=C3N2)C=O

InChI

InChI=1S/C15H18N4O3/c20-10-9-17-5-7-18(8-6-17)14-12(11-21)15(22)19-4-2-1-3-13(19)16-14/h1-4,11,20H,5-10H2/p+2