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

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carbaldehyde Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxo-pyrido[1,2-a]pyrimidine-3-carbaldehyde CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-4-oxo-3-pyrido[1,2-a]pyrimidinecarboxaldehyde IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-oxopyrido[1,2-a]pyrimidine-3-carbaldehyde Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4-keto-pyrido[1,2-a]pyrimidine-3-carbaldehyde Formula: C15H19N4O3+ MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=C(C(=O)N3C=CC=CC3=N2)C=O

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=C(C(=O)N3C=CC=CC3=N2)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+1