butyl-ethyl-[[3-methyl-2,6-bis(oxidanylidene)-7-prop-2-enyl-purin-8-yl]methyl]azanium

Systemtic Name: butyl-ethyl-[[3-methyl-2,6-bis(oxidanylidene)-7-prop-2-enyl-purin-8-yl]methyl]azanium Openeye Name: (7-allyl-3-methyl-2,6-dioxo-purin-8-yl)methyl-butyl-ethyl-ammonium CAS Name: butyl-ethyl-[(3-methyl-2,6-dioxo-7-prop-2-enyl-8-purinyl)methyl]ammonium IUPAC Name: butyl-ethyl-[(3-methyl-2,6-dioxo-7-prop-2-enylpurin-8-yl)methyl]azanium Traditional Name: (7-allyl-2,6-diketo-3-methyl-purin-8-yl)methyl-butyl-ethyl-ammonium Formula: C16H26N5O2+ MolecularWeight: 320.40994

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=NC2=C(N1CC=C)C(=O)NC(=O)N2C

Isomeric SMILES

CCCC[NH+](CC)CC1=NC2=C(N1CC=C)C(=O)NC(=O)N2C

InChI

InChI=1S/C16H25N5O2/c1-5-8-10-20(7-3)11-12-17-14-13(21(12)9-6-2)15(22)18-16(23)19(14)4/h6H,2,5,7-11H2,1,3-4H3,(H,18,22,23)/p+1