furan-2-ylmethyl-[2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]azanium

Systemtic Name: furan-2-ylmethyl-[2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]azanium Openeye Name: 2-furylmethyl-[2-(3-methyl-2,6-dioxo-purin-7-yl)ethyl]ammonium CAS Name: 2-furanylmethyl-[2-(3-methyl-2,6-dioxo-7-purinyl)ethyl]ammonium IUPAC Name: furan-2-ylmethyl-[2-(3-methyl-2,6-dioxopurin-7-yl)ethyl]azanium Traditional Name: 2-(2,6-diketo-3-methyl-purin-7-yl)ethyl-(2-furfuryl)ammonium Formula: C13H16N5O3+ MolecularWeight: 290.29784

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC[NH2+]CC3=CC=CO3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC[NH2+]CC3=CC=CO3

InChI

InChI=1S/C13H15N5O3/c1-17-11-10(12(19)16-13(17)20)18(8-15-11)5-4-14-7-9-3-2-6-21-9/h2-3,6,8,14H,4-5,7H2,1H3,(H,16,19,20)/p+1