N-propyl-N-[[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl]propan-1-amine oxide

Systemtic Name: N-propyl-N-[[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl]propan-1-amine oxide Openeye Name: N-propyl-N-[(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)methyl]propan-1-amine oxide CAS Name: N-propyl-N-[(1,3,7-trimethyl-2,6-dioxo-8-purinyl)methyl]-1-propanamine oxide IUPAC Name: N-propyl-N-[(1,3,7-trimethyl-2,6-dioxopurin-8-yl)methyl]propan-1-amine oxide Traditional Name: N-[(2,6-diketo-1,3,7-trimethyl-purin-8-yl)methyl]-N-propyl-propan-1-amine oxide Formula: C15H25N5O3 MolecularWeight: 323.3907

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CCC)(CC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C)[O-]

Isomeric SMILES

CCC[N+](CCC)(CC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C)[O-]

InChI

InChI=1S/C15H25N5O3/c1-6-8-20(23,9-7-2)10-11-16-13-12(17(11)3)14(21)19(5)15(22)18(13)4/h6-10H2,1-5H3