3-ethyl-9-(furan-2-ylmethyl)-1-methyl-6,7,8,10-tetrahydropurino[7,8-a]pyrimidin-9-ium-2,4-dione

Systemtic Name: 3-ethyl-9-(furan-2-ylmethyl)-1-methyl-6,7,8,10-tetrahydropurino[7,8-a]pyrimidin-9-ium-2,4-dione Openeye Name: 3-ethyl-9-(2-furylmethyl)-1-methyl-6,7,8,10-tetrahydropurino[7,8-a]pyrimidin-9-ium-2,4-dione CAS Name: 3-ethyl-9-(2-furanylmethyl)-1-methyl-6,7,8,10-tetrahydropurino[7,8-a]pyrimidin-9-ium-2,4-dione IUPAC Name: 3-ethyl-9-(furan-2-ylmethyl)-1-methyl-6,7,8,10-tetrahydropurino[7,8-a]pyrimidin-9-ium-2,4-dione Traditional Name: 3-ethyl-9-(2-furfuryl)-1-methyl-6,7,8,10-tetrahydropurino[7,8-a]pyrimidin-9-ium-2,4-quinone Formula: C16H20N5O3+ MolecularWeight: 330.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(NC3=[N+](CCCN23)CC4=CC=CO4)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(NC3=[N+](CCCN23)CC4=CC=CO4)N(C1=O)C

InChI

InChI=1S/C16H19N5O3/c1-3-20-14(22)12-13(18(2)16(20)23)17-15-19(7-5-8-21(12)15)10-11-6-4-9-24-11/h4,6,9H,3,5,7-8,10H2,1-2H3/p+1