[9-(butanoyloxymethyl)purin-2-yl]-dimethyl-oxidanyl-azanium

Systemtic Name: [9-(butanoyloxymethyl)purin-2-yl]-dimethyl-oxidanyl-azanium Openeye Name: [9-(butanoyloxymethyl)purin-2-yl]-hydroxy-dimethyl-ammonium CAS Name: hydroxy-dimethyl-[9-(1-oxobutoxymethyl)-2-purinyl]ammonium IUPAC Name: [9-(butanoyloxymethyl)purin-2-yl]-hydroxy-dimethylazanium Traditional Name: [9-(butyryloxymethyl)purin-2-yl]-hydroxy-dimethyl-ammonium Formula: C12H18N5O3+ MolecularWeight: 280.30302

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCN1C=NC2=CN=C(N=C21)[N+](C)(C)O

Isomeric SMILES

CCCC(=O)OCN1C=NC2=CN=C(N=C21)[N+](C)(C)O

InChI

InChI=1S/C12H18N5O3/c1-4-5-10(18)20-8-16-7-14-9-6-13-12(15-11(9)16)17(2,3)19/h6-7,19H,4-5,8H2,1-3H3/q+1