Ethyl 4-[1-methyl-3-(2-methylpropyl)-2,4-dioxo-4a,6,7,8-tetrahydropurino[7,8-a]pyrimidin-5-ium-9-yl]benzoate

Modify Date: 2025-09-01 23:44:33

Ethyl 4-[1-methyl-3-(2-methylpropyl)-2,4-dioxo-4a,6,7,8-tetrahydropurino[7,8-a]pyrimidin-5-ium-9-yl]benzoate Structure
Ethyl 4-[1-methyl-3-(2-methylpropyl)-2,4-dioxo-4a,6,7,8-tetrahydropurino[7,8-a]pyrimidin-5-ium-9-yl]benzoate structure
Common Name Ethyl 4-[1-methyl-3-(2-methylpropyl)-2,4-dioxo-4a,6,7,8-tetrahydropurino[7,8-a]pyrimidin-5-ium-9-yl]benzoate
CAS Number 893955-23-2 Molecular Weight 426.5
Density N/A Boiling Point N/A
Molecular Formula C22H28N5O4+ Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Ethyl 4-[1-methyl-3-(2-methylpropyl)-2,4-dioxo-4a,6,7,8-tetrahydropurino[7,8-a]pyrimidin-5-ium-9-yl]benzoate

 Chemical & Physical Properties

Molecular Formula C22H28N5O4+
Molecular Weight 426.5
InChIKey IJKWJXNRLWTIFY-UHFFFAOYSA-N
SMILES CCOC(=O)c1ccc(N2CCC[N+]3=C2N=C2C3C(=O)N(CC(C)C)C(=O)N2C)cc1
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