9-(4-nitrophenyl)sulfonyl-3H-purine-2,6-dione

Systemtic Name: 9-(4-nitrophenyl)sulfonyl-3H-purine-2,6-dione Openeye Name: 9-(4-nitrophenyl)sulfonyl-3H-purine-2,6-dione CAS Name: 9-(4-nitrophenyl)sulfonyl-3H-purine-2,6-dione IUPAC Name: 9-(4-nitrophenyl)sulfonyl-3H-purine-2,6-dione Traditional Name: 9-nosylxanthine Formula: C11H7N5O6S MolecularWeight: 337.26818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)N2C=NC3=C2NC(=O)NC3=O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)N2C=NC3=C2NC(=O)NC3=O

InChI

InChI=1S/C11H7N5O6S/c17-10-8-9(13-11(18)14-10)15(5-12-8)23(21,22)7-3-1-6(2-4-7)16(19)20/h1-5H,(H2,13,14,17,18)