7-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-9H-purin-7-ium-2,6-dione

Systemtic Name: 7-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-9H-purin-7-ium-2,6-dione Openeye Name: 7-(2-indolin-1-yl-2-oxo-ethyl)-1,3-dimethyl-9H-purin-7-ium-2,6-dione CAS Name: 7-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-1,3-dimethyl-9H-purin-7-ium-2,6-dione IUPAC Name: 7-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-1,3-dimethyl-9H-purin-7-ium-2,6-dione Traditional Name: 7-(2-indolin-1-yl-2-keto-ethyl)-1,3-dimethyl-9H-purin-7-ium-2,6-quinone Formula: C17H18N5O3+ MolecularWeight: 340.35652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)[N+](=CN2)CC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)[N+](=CN2)CC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C17H17N5O3/c1-19-15-14(16(24)20(2)17(19)25)21(10-18-15)9-13(23)22-8-7-11-5-3-4-6-12(11)22/h3-6,10H,7-9H2,1-2H3/p+1