1,3,7-trimethyl-8-phenylazanyl-9H-purin-7-ium-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-phenylazanyl-9H-purin-7-ium-2,6-dione Openeye Name: 8-anilino-1,3,7-trimethyl-9H-purin-7-ium-2,6-dione CAS Name: 8-anilino-1,3,7-trimethyl-9H-purin-7-ium-2,6-dione IUPAC Name: 8-anilino-1,3,7-trimethyl-9H-purin-7-ium-2,6-dione Traditional Name: 8-anilino-1,3,7-trimethyl-9H-purin-7-ium-2,6-quinone Formula: C14H16N5O2+ MolecularWeight: 286.30914

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)[N+](=C(N2)NC3=CC=CC=C3)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)[N+](=C(N2)NC3=CC=CC=C3)C

InChI

InChI=1S/C14H15N5O2/c1-17-10-11(18(2)14(21)19(3)12(10)20)16-13(17)15-9-7-5-4-6-8-9/h4-8H,1-3H3,(H,15,16,20)/p+1