methyl-[[3-methyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[[3-methyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(3-methyl-2,6-dioxo-7H-purin-8-yl)methyl]ammonium CAS Name: methyl-[(3-methyl-2,6-dioxo-7H-purin-8-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(3-methyl-2,6-dioxo-7H-purin-8-yl)methyl]azanium Traditional Name: benzyl-[(2,6-diketo-3-methyl-7H-purin-8-yl)methyl]-methyl-ammonium Formula: C15H18N5O2+ MolecularWeight: 300.33572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)NC(=N2)C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)NC(=N2)C[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C15H17N5O2/c1-19(8-10-6-4-3-5-7-10)9-11-16-12-13(17-11)20(2)15(22)18-14(12)21/h3-7H,8-9H2,1-2H3,(H,16,17)(H,18,21,22)/p+1