2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-6-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-6-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-6-isopropyl-1H-pyrimidin-4-one CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-6-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-6-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-6-isopropyl-1H-pyrimidin-4-one Formula: C13H23N4O2+ MolecularWeight: 267.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N=C(N1)N2CC[NH+](CC2)CCO

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)N2CC[NH+](CC2)CCO

InChI

InChI=1S/C13H22N4O2/c1-10(2)11-9-12(19)15-13(14-11)17-5-3-16(4-6-17)7-8-18/h9-10,18H,3-8H2,1-2H3,(H,14,15,19)/p+1